Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.31 |
| ▸ | CTSL | P07711 | 1/20 | 0.31 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.30 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.30 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL329899 | 1.00 | SMN1; SMN2 (0.37) | SMN1; SMN2ALDH1A1KMT2AMEN1TSHR | |
| SCHEMBL2052402 | 1.00 | SMN1; SMN2 (0.37) | SMN1; SMN2ALDH1A1KMT2AMEN1TSHR | |
| SCHEMBL4299028 | 1.00 | SMN1; SMN2 (0.37) | SMN1; SMN2ALDH1A1KMT2AMEN1TSHR | |
| SCHEMBL329900 | 1.00 | SMN1; SMN2 (0.37) | SMN1; SMN2ALDH1A1KMT2AMEN1TSHR | |
| SCHEMBL12468506 | 1.00 | SMN1; SMN2 (0.37) | SMN1; SMN2ALDH1A1KMT2AMEN1TSHR | |
| SCHEMBL1537604 | 1.00 | SMN1; SMN2 (0.37) | SMN1; SMN2ALDH1A1KMT2AMEN1TSHR | |
| SCHEMBL13817962 | 1.00 | SMN1; SMN2 (0.37) | SMN1; SMN2ALDH1A1KMT2AMEN1TSHR | |
| SCHEMBL5036319 | 1.00 | SMN1; SMN2 (0.37) | SMN1; SMN2ALDH1A1KMT2AMEN1TSHR | |
| Hydrochloric Acid SCHEMBL7644054 | 0.99 | SMN1; SMN2 (0.37) | SMN1; SMN2ALDH1A1KMT2AMEN1TSHR | |
| Hydrochloric Acid SCHEMBL1536344 | 0.99 | SMN1; SMN2 (0.37) | SMN1; SMN2ALDH1A1KMT2AMEN1TSHR |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 13 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2225249-A1 | PROCESS FOR THE PREPARATION OF A MACROCYCLE | F. Hoffmann-La Roche AG (CH) | 2010-09-08 | — | — | EP | disclosed |
| EP-2150548-A1 | PROCESS FOR HCV PROTEASE INHIBITOR INTERMEDIATE | F. Hoffmann-Roche AG (CH) | 2010-02-10 | — | — | EP | disclosed |
| EP-2086963-A2 | HEPATITIS C VIRUS INHIBITORS | Brystol-Myers Squibb Company (US) | 2009-08-12 | — | — | EP | disclosed |
| EP-2086995-A1 | HEPATITIS C VIRUS INHIBITORS | Brystol-Myers Squibb Company (US) | 2009-08-12 | — | — | EP | disclosed |
| WO-2009080542-A1 | PROCESS FOR THE PREPARATION OF A MACROCYCLE | F. HOFFMANN-LA ROCHE AG (CH) | 2009-07-02 | — | — | WO | disclosed |
| EP-2049474-A2 | HEPATITIS C VIRUS INHIBITORS | Bristol-Myers Squibb Company (US) | 2009-04-22 | — | — | EP | disclosed |
| WO-2008128921-A1 | PROCESS FOR HCV PROTEASE INHIBITOR INTERMEDIATE | F. HOFFMANN-LA ROCHE AG (CH) | 2008-10-30 | — | — | WO | disclosed |
| WO-2008064066-A1 | HEPATITIS C VIRUS INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2008-05-29 | — | — | WO | disclosed |
| WO-2008060927-A2 | HEPATITIS C VIRUS INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2008-05-22 | — | — | WO | disclosed |
| WO-2008008776-A2 | HEPATITIS C VIRUS INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2008-01-17 | — | — | WO | disclosed |
| EP-1629000-A4 | MACROCYCLIC ISOQUINOLINE PEPTIDE INHIBITORS OF HEPATITIS C VIRUS | BRISTOL MYERS SQUIBB CO (US) | 2006-11-29 | — | — | EP | disclosed |
| EP-1629000-A2 | MACROCYCLIC ISOQUINOLINE PEPTIDE INHIBITORS OF HEPATITIS C VIRUS | Bristol-Myers Squibb Company (US) | 2006-03-01 | — | — | EP | disclosed |
| WO-2004094452-A2 | MACROCYCLIC ISOQUINOLINE PEPTIDE INHIBITORS OF HEPATITIS C VIRUS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2004-11-04 | — | — | WO | disclosed |