Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.48 |
| ▸ | RAB9A | P51151 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 4/20 | 0.45 |
| ▸ | TP53 | P04637 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.43 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.42 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.42 |
| ▸ | BCL2 | P10415 | 4/20 | 0.42 |
| ▸ | BCL2L1 | Q07817 | 4/20 | 0.42 |
| ▸ | MCL1 | Q07820 | 4/20 | 0.42 |
| ▸ | BCL2A1 | Q16548 | 4/20 | 0.42 |
| ▸ | BAK1 | Q16611 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7195286 | 0.89 | KMT2A (0.52) | MAPTSMN1; SMN2LMNA | |
| SCHEMBL7561990 | 0.82 | NPC1 (0.50) | NPC1RAB9AMAPTTP53SMN1; SMN2 | |
| SCHEMBL7592814 | 0.82 | HDAC6 (0.43) | MAPTLMNA | |
| SCHEMBL7674538 | 0.78 | SIRT2 (0.51) | NPC1RAB9ASMN1; SMN2LMNA | |
| SCHEMBL2481230 | 0.77 | NPC1 (0.67) | NPC1RAB9AMAPTTP53SMN1; SMN2 | |
| SCHEMBL5709362 | 0.77 | NPC1 (0.67) | NPC1RAB9AMAPTTP53SMN1; SMN2 | |
| SCHEMBL8162012 | 0.72 | NPC1 (0.61) | NPC1RAB9AMAPTTP53SMN1; SMN2 | |
| SCHEMBL7597518 | 0.71 | TP53 (0.50) | NPC1RAB9AMAPTTP53LMNA | |
| SCHEMBL7182870 | 0.71 | IMPDH2 (0.44) | RAB9AMAPTROCK2ROCK1 | |
| SCHEMBL6196126 | 0.71 | NPC1 (0.57) | NPC1RAB9AMAPTTP53SMN1; SMN2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1274676-A2 | POLYCYCLIC ARYL AND HETEROARYL SUBSTITUTED 1,4-QUINONES USEFUL FOR SELECTIVE INHIBITION OF THE COAGULATION CASCADE | Pharmacia Corporation (US) | 2003-01-15 | — | — | EP | claimed |
| WO-2001079155-A2 | POLYCYCLIC ARYL AND HETEROARYL SUBSTITUTED 1,4-QUINONES USEFUL FOR SELECTIVE INHIBITION OF THE COAGULATION CASCADE | PHARMACIA CORPORATION (US) | 2001-10-25 | — | — | WO | claimed |