Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMPD1 | P17405 | 2/20 | 0.60 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.55 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.55 |
| ▸ | CXCR1 | P25024 | 10/20 | 0.53 |
| ▸ | FAAH | O00519 | 1/20 | 0.46 |
| ▸ | ALPL | P05186 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL677623 | 0.98 | SMPD1 (0.57) | SMPD1CYP1A2CYP19A1CYP2C9CYP2C19 | |
| SCHEMBL12243215 | 0.87 | SMPD1 (0.63) | SMPD1CYP1A2CYP19A1CYP2C9CYP2C19 | |
| SCHEMBL2354038 | 0.87 | SMPD1 (0.63) | SMPD1CYP1A2CYP19A1CYP2C9CYP2C19 | |
| SCHEMBL2351006 | 0.86 | SMPD1 (0.65) | SMPD1CYP1A2CYP19A1CYP2C9CYP2C19 | |
| SCHEMBL903875 | 0.85 | SMPD1 (0.61) | SMPD1CYP1A2CYP19A1CYP2C9CYP2C19 | |
| SCHEMBL2353533 | 0.85 | RARB (0.64) | SMPD1CYP1A2CYP19A1CYP2C9CYP2C19 | |
| SCHEMBL7403884 | 0.85 | RARB (0.64) | SMPD1CYP1A2CYP19A1CYP2C9CYP2C19 | |
| SCHEMBL677604 | 0.84 | RAB9A (0.63) | CYP1A2MAPTSMN1; SMN2 | |
| SCHEMBL12243204 | 0.84 | SMPD1 (0.60) | SMPD1CYP1A2CYP19A1CYP2C9CYP2C19 | |
| SCHEMBL2354881 | 0.84 | RARB (0.67) | SMPD1CYP1A2CYP19A1CYP2C9CYP2C19 |
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-2016201283-A1 | ANTIFUNGAL AGENTS | CIDARA THERAPEUTICS, INC. (US) | 2016-12-15 | — | — | WO | disclosed |