Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 10/20 | 0.50 |
| ▸ | RAB9A | P51151 | 10/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.50 |
| ▸ | HPGD | P15428 | 3/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.47 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.47 |
| ▸ | RELA | Q04206 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | GFER | P55789 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | TAS1R3 | Q7RTX0 | 2/20 | 0.45 |
| ▸ | TAS1R1 | Q7RTX1 | 2/20 | 0.45 |
| ▸ | TAS1R2 | Q8TE23 | 2/20 | 0.45 |
| ▸ | MAOA | P21397 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6248854 | 0.98 | NPC1 (0.48) | NPC1RAB9ASMN1; SMN2HPGDKMT2A | |
| SCHEMBL8591829 | 0.90 | NPC1 (0.56) | NPC1RAB9ASMN1; SMN2HPGDKMT2A | |
| SCHEMBL6243345 | 0.83 | NPC1 (0.49) | NPC1RAB9ASMN1; SMN2HPGDKMT2A | |
| SCHEMBL7091957 | 0.83 | NPC1 (0.49) | NPC1RAB9ASMN1; SMN2HPGDKMT2A | |
| SCHEMBL6241645 | 0.81 | RAB9A (0.47) | NPC1RAB9ASMN1; SMN2HPGDKMT2A | |
| SCHEMBL6245040 | 0.78 | RAB9A (0.43) | NPC1RAB9ASMN1; SMN2HPGDKMT2A | |
| SCHEMBL2915946 | 0.77 | KMT2A (0.69) | NPC1RAB9ASMN1; SMN2HPGDKMT2A | |
| SCHEMBL9978790 | 0.77 | KMT2A (0.69) | NPC1RAB9ASMN1; SMN2HPGDKMT2A | |
| SCHEMBL2908851 | 0.77 | KMT2A (0.69) | NPC1RAB9ASMN1; SMN2HPGDKMT2A | |
| SCHEMBL9979280 | 0.77 | KMT2A (0.69) | NPC1RAB9ASMN1; SMN2HPGDKMT2A |
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-1292579-A1 | SUBSTITUTED POLYCYCLIC ARYL AND HETEROARYL PYRAZINONES USEFUL FOR SELECTIVE INHIBITION OF THE COAGULATION CASCADE | Pharmacia Corporation (US) | 2003-03-19 | — | — | EP | claimed |
| WO-2001087854-A1 | SUBSTITUTED POLYCYCLIC ARYL AND HETEROARYL PYRAZINONES USEFUL FOR SELECTIVE INHIBITION OF THE COAGULATION CASCADE | PHARMACIA CORPORATION (US) | 2001-11-22 | — | — | WO | claimed |