Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.34 |
| ▸ | HPGD | P15428 | 7/20 | 0.34 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.32 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | ELANE | P08246 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | RECQL | P46063 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8039874 | 0.78 | — | — | |
| Hydrochloric Acid SCHEMBL8039821 | 0.77 | — | — | |
| SCHEMBL8406550 | 0.71 | GLA (0.34) | MCL1 | |
| SCHEMBL8024263 | 0.66 | MMP8 (0.51) | ALDH1A1CYP1A2HSD17B10L3MBTL1NPC1 | |
| SCHEMBL8083188 | 0.65 | KDM4E (0.43) | ALDH1A1KDM4EHPGDCYP1A2HSD17B10 | |
| Hydrochloric Acid SCHEMBL8083185 | 0.64 | KDM4E (0.42) | ALDH1A1KDM4EHPGDCYP1A2HSD17B10 | |
| SCHEMBL8038415 | 0.64 | ABL1 (0.31) | MCL1 | |
| SCHEMBL20346300 | 0.64 | ADORA3 (0.49) | ALDH1A1KDM4EHPGDADORA3CYP1A2 | |
| SCHEMBL7815658 | 0.64 | CYP3A4 (0.40) | ALDH1A1KDM4EHPGDCYP2C9CYP2C19 | |
| SCHEMBL8037995 | 0.64 | LOXL2 (0.40) | ALDH1A1HPGDADORA3CYP1A2CYP2C9 |
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-6060508-A | FOR TREATING URINARY STRESS INCONTINENCE, GASTROINTESTINAL DISORDERS, ULCERS, MIGRAINES | SYNTHELABO (FR) | 2000-05-09 | — | — | US | disclosed |