Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 1.00 |
| ▸ | RAB9A | P51151 | 4/20 | 1.00 |
| ▸ | MAPT | P10636 | 1/20 | 0.84 |
| ▸ | ALPL | P05186 | 1/20 | 0.72 |
| ▸ | ALPI | P09923 | 1/20 | 0.72 |
| ▸ | MEN1 | O00255 | 1/20 | 0.70 |
| ▸ | LMNA | P02545 | 1/20 | 0.70 |
| ▸ | PKM | P14618 | 1/20 | 0.70 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.70 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.70 |
| ▸ | CCNA2 | P20248 | 2/20 | 0.66 |
| ▸ | CDK2 | P24941 | 2/20 | 0.66 |
| ▸ | CCNA1 | P78396 | 2/20 | 0.66 |
| ▸ | EIF2AK2 | P19525 | 1/20 | 0.65 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.62 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.62 |
| ▸ | NPY5R | Q15761 | 2/20 | 0.59 |
| ▸ | BCHE | P06276 | 1/20 | 0.58 |
| ▸ | ACHE | P22303 | 1/20 | 0.58 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL1663611 | 0.94 | NPC1 (0.89) | NPC1RAB9AMAPTALPLALPI | |
| SCHEMBL6566353 | 0.91 | NPC1 (1.00) | NPC1RAB9AMAPTALPLALPI | |
| SCHEMBL7514363 | 0.88 | NPC1 (0.78) | NPC1RAB9AMAPTALPLALPI | |
| SCHEMBL29466507 | 0.83 | MEN1 (0.78) | NPC1RAB9AMAPTALPLALPI | |
| SCHEMBL4264906 | 0.82 | ALPL (0.78) | NPC1RAB9AMAPTALPLALPI | |
| SCHEMBL1665225 | 0.82 | RAB9A (0.69) | NPC1RAB9AMAPTALPLALPI | |
| SCHEMBL6565951 | 0.81 | ALPL (0.76) | NPC1RAB9AMAPTALPLALPI | |
| SCHEMBL6564725 | 0.81 | RAB9A (1.00) | NPC1RAB9AMAPTALPLALPI | |
| SCHEMBL17283670 | 0.81 | CCNA2 (0.69) | NPC1RAB9AMAPTALPLALPI | |
| SCHEMBL1664228 | 0.81 | RAB9A (0.68) | NPC1RAB9AMAPTALPLALPI |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0788358-B1 | USE OF PYRAZOLE COMPOUNDS FOR THE TREATMENT OF GLOMERULONEPHRITIS, CANCER, ATHEROSCLEROSIS OR RESTENOSIS | MILLENNIUM PHARM INC (US) | 2004-03-31 | — | — | EP | disclosed |
| US-5916908-A | Pharmaceutical pyrazole compositions useful as inhibitors of protein kinases | COR THERAPEUTICS, INC. (US) | 1999-06-29 | — | — | US | disclosed |
| CN-1165482-A | Pyrazole pharmaceutical compositions as protein kinase inhibitors | COR THERAPEUTICS INC (US) | 1997-11-19 | — | — | CN | disclosed |
| EP-0788358-A2 | PHARMACEUTICAL PYRAZOLE COMPOSITIONS USEFUL AS INHIBITORS OF PROTEIN KINASES | COR THERAPEUTICS, INC. (US) | 1997-08-13 | — | — | EP | disclosed |
| WO-1996014843-A2 | PHARMACEUTICAL PYRAZOLE COMPOSITIONS USEFUL AS INHIBITORS OF PROTEIN KINASES | COR THERAPEUTICS, INC. (US) | 1996-05-23 | — | — | WO | disclosed |