Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTA4H | P09960 | 1/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.50 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.49 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.48 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.47 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.47 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.46 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.46 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.46 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL7380489 | 0.90 | CYP1A2 (0.48) | LTA4HCYP1A2CYP2D6NAPRTCHRNA7 | |
| SCHEMBL5454062 | 0.85 | GAA (0.50) | CYP1A2CYP2D6CHRNA7CHRNB2CHRNA4 | |
| SCHEMBL5460631 | 0.85 | NR1H3 (0.46) | CYP1A2CYP2D6CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL7452984 | 0.82 | CYP1A2 (0.63) | LTA4HCYP1A2CYP2D6NAPRTCHRNA7 | |
| SCHEMBL7374908 | 0.82 | KCNA5 (0.52) | LTA4HCYP11B1CYP11B2 | |
| SCHEMBL27496388 | 0.82 | CHRNA7 (0.57) | CYP1A2CYP2D6NAPRTCYP3A4CYP2C9 | |
| SCHEMBL6133002 | 0.82 | NAPRT (0.48) | CYP1A2CYP2D6NAPRTCYP3A4CYP2C9 | |
| SCHEMBL4072842 | 0.81 | CYP1A2 (0.62) | LTA4HCYP1A2CYP2D6 | |
| SCHEMBL7383494 | 0.81 | IDO1 (0.48) | CYP1A2CYP2D6CYP3A4CHRNA7CYP11B1 | |
| SCHEMBL4068318 | 0.81 | CYP1A2 (0.58) | LTA4HCYP1A2CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| US-5830915-A | ORAL DISEASES; SKIN DISORDERS; ANTIINFLAMMATORY AGENTS | THE PROCTER & GAMBLE COMPANY (US) | 1998-11-03 | — | — | US | disclosed |