Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | HTT | P42858 | 2/20 | 0.47 |
| ▸ | XBP1 | P17861 | 1/20 | 0.47 |
| ▸ | HTR6 | P50406 | 1/20 | 0.45 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.42 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL10467279 | 0.92 | HTR6 (0.44) | ALDH1A1HTTXBP1HTR6 | |
| SCHEMBL10468521 | 0.80 | HTR6 (0.44) | HTR6 | |
| SCHEMBL31522110 | 0.79 | CYP19A1 (0.49) | ALDH1A1CYP19A1TBXAS1 | |
| SCHEMBL1125535 | 0.79 | CYP19A1 (0.49) | ALDH1A1CYP19A1TBXAS1 | |
| SCHEMBL7898127 | 0.78 | IDO1 (0.52) | HTR6CYP19A1TBXAS1 | |
| SCHEMBL10467840 | 0.78 | SIGMAR1 (0.50) | HTR6 | |
| Hydrochloric Acid SCHEMBL9521626 | 0.78 | HTR1A (0.40) | — | |
| SCHEMBL10469027 | 0.78 | HTR2A (0.37) | ALDH1A1HTTXBP1 | |
| SCHEMBL10467206 | 0.77 | HTR6 (0.42) | ALDH1A1HTTXBP1HTR6CYP19A1 | |
| SCHEMBL17602126 | 0.77 | KDM4C (0.48) | ALDH1A1HTTXBP1HTR6CYP19A1 |
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-4957914-A | ANTIDEPRESSANTS, ANXIOLYTICS, HYPOTENSIVE AGENTS | SYNTEX (U.S.A.) INC. (US) | 1990-09-18 | — | — | US | disclosed |