Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.33 |
| ▸ | CTSL | P07711 | 1/20 | 0.33 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.33 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.33 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.32 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.32 |
| ▸ | RELA | Q04206 | 1/20 | 0.32 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL5427004 | 1.00 | KMT2A (0.39) | KMT2AALDH1A1MEN1TSHRMAPK1 | |
| SCHEMBL2630591 | 0.87 | KMT2A (0.40) | KMT2AALDH1A1MEN1TSHRMAPK1 | |
| SCHEMBL10089091 | 0.85 | KMT2A (0.37) | KMT2AALDH1A1MEN1TSHRMAPK1 | |
| SCHEMBL13415252 | 0.85 | KMT2A (0.37) | KMT2AALDH1A1MEN1TSHRMAPK1 | |
| SCHEMBL15424510 | 0.84 | MAPK1 (0.42) | KMT2AALDH1A1MEN1MAPK1CACNA1H | |
| SCHEMBL20629740 | 0.84 | MAPK1 (0.42) | KMT2AALDH1A1MEN1MAPK1CACNA1H | |
| SCHEMBL15424518 | 0.84 | MAPK1 (0.42) | KMT2AALDH1A1MEN1MAPK1CACNA1H | |
| SCHEMBL1433455 | 0.83 | KMT2A (0.38) | KMT2AALDH1A1MEN1TSHRMAPK1 | |
| SCHEMBL6051013 | 0.83 | KMT2A (0.38) | KMT2AALDH1A1MEN1TSHRMAPK1 | |
| SCHEMBL375218 | 0.83 | KMT2A (0.38) | KMT2AALDH1A1MEN1TSHRMAPK1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2813500-B1 | Intermediates for the preparation of hepatitis C virus inhibitors | BRISTOL MYERS SQUIBB CO (US) | 2016-08-17 | — | — | EP | disclosed |
| EP-1863793-B1 | HEPATITIS C VIRUS INHIBITORS | BRISTOL MYERS SQUIBB CO (US) | 2012-07-04 | — | — | EP | disclosed |
| WO-2008064066-A1 | HEPATITIS C VIRUS INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2008-05-29 | — | — | WO | disclosed |