Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 5/20 | 0.36 |
| ▸ | RAB9A | P51151 | 5/20 | 0.36 |
| ▸ | MEN1 | O00255 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | CASP3 | P42574 | 1/20 | 0.36 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.36 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.36 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.36 |
| ▸ | KDR | P35968 | 5/20 | 0.35 |
| ▸ | GRM4 | Q14833 | 2/20 | 0.33 |
| ▸ | P2RY1 | P47900 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | KAT6A | Q92794 | 1/20 | 0.33 |
| ▸ | KAT5 | Q92993 | 1/20 | 0.33 |
| ▸ | KAT8 | Q9H7Z6 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 2/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.32 |
| ▸ | SGMS2 | Q8NHU3 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL4239760 | 0.83 | MET (0.38) | NPC1RAB9AMEN1KMT2ACASP3 | |
| SCHEMBL4235797 | 0.81 | KDR (0.40) | NPC1RAB9AMEN1KMT2ACASP3 | |
| SCHEMBL4243041 | 0.77 | SCD (0.43) | — | |
| SCHEMBL4236523 | 0.77 | EGFR (0.41) | NPC1RAB9AMEN1KMT2ACASP3 | |
| Hydrochloric Acid SCHEMBL4234156 | 0.77 | EGFR (0.41) | NPC1RAB9AMEN1KMT2ACASP3 | |
| SCHEMBL4243830 | 0.76 | EGFR (0.39) | NPC1RAB9AMEN1KMT2ACASP3 | |
| SCHEMBL4241653 | 0.74 | JAK2 (0.40) | NPC1RAB9AMEN1KMT2ACASP3 | |
| SCHEMBL4241649 | 0.70 | GRK2 (0.40) | NPC1RAB9AMEN1KMT2ACASP3 | |
| SCHEMBL3359286 | 0.69 | NPC1 (0.46) | NPC1RAB9AMEN1KMT2ACASP3 | |
| SCHEMBL3354854 | 0.68 | GRM4 (0.62) | NPC1RAB9AMEN1KMT2ACASP3 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2009010871-A2 | PYRAZOLE DERIVATIVES AS ANTAGONISTS OF ADENOSINE A3 RECEPTOR | ADDEX PHARMA S.A. (CH) | 2009-01-22 | — | — | WO | disclosed |