Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 5/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.40 |
| ▸ | CTSD | P07339 | 3/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.37 |
| ▸ | POLB | P06746 | 3/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.37 |
| ▸ | DHODH | Q02127 | 1/20 | 0.37 |
| ▸ | NOX4 | Q9NPH5 | 2/20 | 0.36 |
| ▸ | EGFR | P00533 | 1/20 | 0.36 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL4346978 | 0.93 | MAPT (0.41) | LMNAMAPTALDH1A1KDM4ERAB9A | |
| SCHEMBL4346923 | 0.91 | SLC6A4 (0.43) | LMNAMAPTALDH1A1KDM4ECTSD | |
| SCHEMBL4343453 | 0.91 | SMN1; SMN2 (0.43) | MAPTALDH1A1KDM4ERAB9ASMN1; SMN2 | |
| SCHEMBL4351627 | 0.90 | MAPT (0.39) | MAPTALDH1A1CTSDSMN1; SMN2POLB | |
| SCHEMBL6230126 | 0.88 | CTSD (0.44) | LMNAMAPTALDH1A1CTSDRAB9A | |
| SCHEMBL4348911 | 0.88 | MEN1 (0.39) | MAPTCTSDSMN1; SMN2CYP2C9CYP2C19 | |
| SCHEMBL4347108 | 0.87 | KMT2A (0.50) | LMNAMAPTALDH1A1KDM4ECTSD | |
| SCHEMBL6230263 | 0.86 | MAPT (0.37) | LMNAMAPTALDH1A1KDM4ERAB9A | |
| SCHEMBL4351072 | 0.85 | NOX4 (0.41) | LMNAMAPTALDH1A1KDM4ERAB9A | |
| SCHEMBL4345355 | 0.85 | PTPN1 (0.39) | LMNAMAPTALDH1A1CTSDRAB9A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2100876-A2 | New compounds for the inhibition of rotamases and use thereof | Jerini AG (DE) | 2009-09-16 | — | — | EP | claimed |
| CN-1701061-A | Novel compounds for inhibiting rotamase enzymes and uses thereof | JERINI AG (DE) | 2005-11-23 | — | — | CN | claimed |
| WO-2004030664-A2 | NEW COMPOUNDS FOR THE INHIBITION OF UNDESIRED CELL PROLIFERATION AND USE THEREOF | JERINI AG (DE) | 2004-04-15 | — | — | WO | claimed |
| EP-2100876-A2 | New compounds for the inhibition of rotamases and use thereof | Jerini AG (DE) | 2009-09-16 | — | — | EP | disclosed |