Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 11/20 | 0.47 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | GLA | P06280 | 4/20 | 0.43 |
| ▸ | GAA | P10253 | 4/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 4/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | PDE5A | O76074 | 2/20 | 0.41 |
| ▸ | DHODH | Q02127 | 1/20 | 0.38 |
| ▸ | CASP1 | P29466 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8968333 | 0.89 | HTR6 (0.44) | HTR6CYP19A1CYP2C9KDM4EALDH1A1 | |
| SCHEMBL8968998 | 0.81 | ALDH1A1 (0.46) | HTR6CYP19A1CYP2C9KDM4EALDH1A1 | |
| SCHEMBL8968953 | 0.78 | KDM4E (0.63) | HTR6CYP19A1CYP2C9KDM4EALDH1A1 | |
| SCHEMBL8969541 | 0.78 | ALDH1A1 (0.46) | HTR6CYP19A1CYP2C9KDM4EALDH1A1 | |
| SCHEMBL8969938 | 0.78 | KDM4E (0.46) | HTR6CYP19A1CYP2C9KDM4EALDH1A1 | |
| SCHEMBL8969191 | 0.77 | KDM4E (0.44) | HTR6CYP19A1CYP2C9KDM4EALDH1A1 | |
| SCHEMBL8969559 | 0.77 | KDM4E (0.62) | HTR6CYP19A1CYP2C9KDM4EALDH1A1 | |
| SCHEMBL8969532 | 0.75 | KDM4E (0.43) | HTR6KDM4EALDH1A1GLAGAA | |
| SCHEMBL8968935 | 0.73 | HTR6 (0.45) | HTR6CYP2C9KDM4EALDH1A1GLA | |
| SCHEMBL8969987 | 0.72 | ALDH1A1 (0.43) | HTR6CYP19A1CYP2C9KDM4EALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5486512-A | LEARNING ENHANCEMENT | WARNER-LAMBERT COMPANY (US) | 1996-01-23 | — | — | US | disclosed |
| WO-1993003034-A1 | QUINAZOLINE DERIVATIVES AS ACETYLCHOLINESTERASE INHIBITORS | WARNER-LAMBERT COMPANY (US) | 1993-02-18 | — | — | WO | disclosed |