Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | CASR | P41180 | 1/20 | 0.37 |
| ▸ | G6PD | P11413 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL17184098 | 0.90 | ALDH1A1 (0.43) | ALDH1A1HPGDKDM4EMEN1KMT2A | |
| SCHEMBL6656867 | 0.88 | ALDH1A1 (0.42) | ALDH1A1CYP2C9CYP2C19CYP1A2HPGD | |
| SCHEMBL29160649 | 0.83 | ALDH1A1 (0.42) | ALDH1A1CYP2C9CYP2C19CYP1A2RECQL | |
| SCHEMBL15562148 | 0.82 | ALDH1A1 (0.44) | ALDH1A1CYP2C9CYP2C19CYP1A2SLC6A4 | |
| SCHEMBL9401933 | 0.81 | CYP2C9 (0.43) | ALDH1A1CYP2C9CYP2C19CYP1A2SLC6A4 | |
| Ammonia Solution, Strong SCHEMBL28352063 | 0.79 | CYP2C9 (0.39) | ALDH1A1CYP2C9CYP2C19CYP1A2SLC6A4 | |
| SCHEMBL2351888 | 0.75 | PARL (0.41) | ALDH1A1CYP2C9CYP2C19CYP1A2HPGD | |
| SCHEMBL2476595 | 0.74 | HCAR2 (0.40) | ALDH1A1HPGDKDM4EMAPTKMT2A | |
| SCHEMBL11672371 | 0.74 | ALDH1A1 (0.54) | ALDH1A1CYP2C9CYP2C19CYP1A2SLC6A4 | |
| SCHEMBL6248166 | 0.74 | ALDH1A1 (0.54) | ALDH1A1CYP2C9CYP2C19CYP1A2SLC6A4 |
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-5175157-A | Cardiovascular disorders | BOEHRINGER INGELHEIM GMBH (DE) | 1992-12-29 | — | — | US | disclosed |