Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | CPA1 | P15085 | 4/20 | 0.46 |
| ▸ | CPA3 | P15088 | 3/20 | 0.46 |
| ▸ | FOLH1 | Q04609 | 2/20 | 0.46 |
| ▸ | CPB1 | P15086 | 1/20 | 0.46 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | SOAT2 | O75908 | 1/20 | 0.43 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.43 |
| ▸ | LTA4H | P09960 | 2/20 | 0.43 |
| ▸ | MME | P08473 | 1/20 | 0.43 |
| ▸ | ALPL | P05186 | 1/20 | 0.43 |
| ▸ | ALPI | P09923 | 1/20 | 0.43 |
| ▸ | ALPG | P10696 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL13821917 | 0.79 | CYP1A2 (0.55) | CYP1A2NPC1RAB9AMAPTCPA1 | |
| SCHEMBL9739581 | 0.78 | CPA1 (0.60) | CYP1A2MAPTCPA1CPA3FOLH1 | |
| SCHEMBL15314130 | 0.75 | CYP3A4 (0.59) | CYP1A2NPC1RAB9AMAPTSMN1; SMN2 | |
| SCHEMBL11471148 | 0.74 | CES1 (0.57) | NPC1RAB9AMAPTCYP2C9SMN1; SMN2 | |
| SCHEMBL13575264 | 0.73 | NPC1 (0.47) | CYP1A2NPC1RAB9AMAPT | |
| SCHEMBL22369889 | 0.73 | ALPI (0.58) | NPC1RAB9AMAPTLTA4HALPI | |
| SCHEMBL12234221 | 0.73 | ALPI (0.58) | NPC1RAB9AMAPTLTA4HALPI | |
| SCHEMBL13575244 | 0.73 | NPC1 (0.47) | CYP1A2NPC1RAB9AMAPT | |
| SCHEMBL10025280 | 0.72 | RAB9A (0.71) | NPC1RAB9AMAPTCYP2C9SMN1; SMN2 | |
| SCHEMBL29047084 | 0.72 | EPHX1 (0.56) | CYP1A2NPC1RAB9AMAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-4228082-A | FUNGICIDES OR CHEMICAL INTERMIDIATES FOR 1,2,4-TRIAZINONE HERBICIDES | DEUTSCHE GOLD- UND SILBER-SCHEIDEANSTALT VORMALS ROESSLER (DE) | 1980-10-14 | — | — | US | disclosed |
| US-4224226-A | FUNGICIDES BY CONDENSING AN ACYL CYANIDE WITH EITHER A TERTIARY ALCOHOL OR AN ALKENE | DEUTSCHE GOLD- UND SILBER-SCHEIDEANSTALT VORMALS ROESSLER (DE) | 1980-09-23 | — | — | US | disclosed |