Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.51 |
| ▸ | NPC1 | O15118 | 2/20 | 0.51 |
| ▸ | RAB9A | P51151 | 2/20 | 0.51 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.50 |
| ▸ | TARBP2 | Q15633 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.48 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | CA4 | P22748 | 1/20 | 0.46 |
| ▸ | CA9 | Q16790 | 1/20 | 0.46 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.45 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.44 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.44 |
| ▸ | ELANE | P08246 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL20075545 | 0.89 | LMNA (0.53) | ALDH1A1NPC1RAB9ACA1CA2 | |
| SCHEMBL18590178 | 0.83 | SMN1; SMN2 (0.49) | ALDH1A1SMN1; SMN2NPC1RAB9ACYP19A1 | |
| SCHEMBL16299018 | 0.82 | KDM4E (0.47) | ALDH1A1SMN1; SMN2NPC1RAB9ACYP19A1 | |
| SCHEMBL20074995 | 0.77 | GRM5 (0.43) | ALDH1A1NPC1RAB9ALMNAGRM5 | |
| SCHEMBL5023771 | 0.77 | CNR1 (0.55) | NPC1RAB9ACYP19A1TARBP2CA1 | |
| SCHEMBL3603486 | 0.77 | GRM5 (0.56) | ALDH1A1NPC1RAB9AGABRA2GABRB2 | |
| SCHEMBL10172669 | 0.76 | CYP19A1 (0.44) | ALDH1A1SMN1; SMN2NPC1RAB9ACYP19A1 | |
| SCHEMBL23402785 | 0.76 | GRM5 (0.39) | ALDH1A1SMN1; SMN2NPC1RAB9ACYP2C9 | |
| SCHEMBL10057637 | 0.76 | ALDH1A1 (0.55) | ALDH1A1SMN1; SMN2NPC1RAB9ACYP19A1 | |
| SCHEMBL3595225 | 0.75 | ALDH1A1 (0.49) | ALDH1A1NPC1RAB9ACA1CA2 |
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-2009143039-A2 | HETEROCYCLIC COMPOUNDS AS FACTOR IXA INHIBITORS | SCHERING CORPORATION (US) | 2009-11-26 | — | — | WO | disclosed |