Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | SLC18A3 | Q16572 | 3/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | ABL1 | P00519 | 1/20 | 0.44 |
| ▸ | RIN1 | Q13671 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | CASP1 | P29466 | 1/20 | 0.44 |
| ▸ | CASP7 | P55210 | 1/20 | 0.44 |
| ▸ | DRD2 | P14416 | 1/20 | 0.43 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.43 |
| ▸ | TRPC5 | Q9UL62 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL10967357 | 0.99 | ALDH1A1 (0.47) | ALDH1A1KDM4ESLC18A3POLBTP53 | |
| SCHEMBL10967209 | 0.89 | POLB (0.50) | ALDH1A1POLBTP53ABL1RIN1 | |
| SCHEMBL10971590 | 0.85 | POLB (0.45) | ALDH1A1KDM4EPOLBTP53ABL1 | |
| SCHEMBL10967335 | 0.85 | KDM4E (0.48) | ALDH1A1KDM4ESLC18A3DRD2SIGMAR1 | |
| Hydrochloric Acid SCHEMBL10914569 | 0.84 | ALDH1A1 (0.48) | ALDH1A1KDM4ESLC18A3DRD2SIGMAR1 | |
| Hydrochloric Acid SCHEMBL10972048 | 0.82 | KDM4E (0.47) | ALDH1A1KDM4ESLC18A3DRD2CHRM4 | |
| Hydrochloric Acid SCHEMBL10965609 | 0.82 | ALDH1A1 (0.46) | ALDH1A1KDM4ESLC18A3DRD2CHRM4 | |
| Hydrochloric Acid SCHEMBL10970085 | 0.81 | ALDH1A1 (0.46) | ALDH1A1KDM4ESLC18A3DRD2SIGMAR1 | |
| Hydrochloric Acid SCHEMBL10915699 | 0.81 | SIGMAR1 (0.49) | ALDH1A1KDM4ESLC18A3DRD2SIGMAR1 | |
| Hydrochloric Acid SCHEMBL10970332 | 0.80 | LIPG (0.45) | ALDH1A1KDM4ESLC18A3DRD2CHRM4 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0064706-B1 | 5-(4-PHENYL-1-PIPERIDINYL)METHYL-2,3-DIHYDRO-2-OXO-1H-IMIDAZOLE-4-CARBOXYLIC ACID DERIVATIVES | MERRELL DOW PHARMACEUTICALS INC. (US) | 1985-07-03 | — | — | EP | claimed |
| EP-0064706-A1 | 5-(4-Phenyl-1-piperidinyl)methyl-2,3-dihydro-2-oxo-1H-imidazole-4-carboxylic acid derivatives | MERRELL DOW PHARMACEUTICALS INC. (US) | 1982-11-17 | — | — | EP | claimed |
| US-4329470-A | CORDIOTONIC, HYPOTENSIVE, ANTITHROMBOSIS | MERRELL DOW PHARMACEUTICALS INC. (US) | 1982-05-11 | — | — | US | claimed |
| US-4329470-A | CORDIOTONIC, HYPOTENSIVE, ANTITHROMBOSIS | MERRELL DOW PHARMACEUTICALS INC. (US) | 1982-05-11 | — | — | US | disclosed |