Known targets — ChEMBL curated mechanism
MMP1MMP13MMP7MMP8polrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of Alcohol. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 6/20 | 0.65 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.65 |
| ▸ | HTR2A | P28223 | 8/20 | 0.62 |
| ▸ | HTR7 | P34969 | 7/20 | 0.62 |
| ▸ | KCNH2 | Q12809 | 5/20 | 0.62 |
| ▸ | ACHE | P22303 | 2/20 | 0.60 |
| ▸ | DRD3 | P35462 | 1/20 | 0.59 |
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 SCHEMBL9075374 | 0.89 | DRD2 (0.65) | DRD2SLC6A4HTR2AHTR7KCNH2 | |
| SCHEMBL10637192 | 0.86 | HTT (0.61) | HTR2AHTR7DRD3 | |
| Hydrochloric Acid SCHEMBL1545598 | 0.84 | DRD2 (0.69) | DRD2SLC6A4HTR2AHTR7KCNH2 | |
| SCHEMBL1545554 | 0.83 | DRD2 (0.70) | DRD2SLC6A4HTR2AHTR7KCNH2 | |
| SCHEMBL1545147 | 0.83 | ACHE (0.61) | DRD2SLC6A4ACHE | |
| Alcohol SCHEMBL7723584 | 0.83 | DRD2 (0.69) | DRD2SLC6A4HTR2AHTR7KCNH2 | |
| SCHEMBL14282338 | 0.82 | ACHE (0.60) | DRD2SLC6A4ACHE | |
| SCHEMBL28522065 | 0.82 | DRD2 (0.62) | DRD2SLC6A4HTR2AHTR7KCNH2 | |
| SCHEMBL28522063 | 0.82 | DRD2 (0.62) | DRD2SLC6A4HTR2AHTR7KCNH2 | |
| Hydrochloric Acid SCHEMBL2778704 | 0.82 | HTR2A (0.56) | DRD2SLC6A4HTR2AHTR7KCNH2 |
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-RE37729-E1 | 4-Heteroaryl-1-piperidinealkylamines and derivatives thereof and their therapeutic utility | AVENTIS PHARMACEUTICALS INC. | 2002-06-04 | — | — | US | disclosed |
| US-RE37029-E1 | ANTIPSYCHOTIC AND ANALGESIC AGENTS | AVENTIS PHARMACEUTICALS INC. | 2001-01-23 | — | — | US | disclosed |