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 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | ADRB3 | P13945 | 15/20 | 0.46 |
| ▸ | ADRB1 | P08588 | 7/20 | 0.46 |
| ▸ | ADRB2 | P07550 | 3/20 | 0.43 |
| ▸ | GPR55 | Q9Y2T6 | 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 | |
|---|---|---|---|---|
| SCHEMBL9787801 | 0.91 | ADRB3 (0.51) | MEN1KMT2AKDM4EGAASMN1; SMN2 | |
| Alcohol SCHEMBL9787776 | 0.84 | ADRB3 (0.51) | MEN1KMT2AKDM4EGAASMN1; SMN2 | |
| Oxalic Acid SCHEMBL9787794 | 0.81 | MEN1 (0.52) | MEN1KMT2AKDM4EGAASMN1; SMN2 | |
| SCHEMBL10594495 | 0.78 | ADRB2 (0.51) | MEN1KMT2AKDM4EGAASMN1; SMN2 | |
| SCHEMBL9787784 | 0.77 | ADRB3 (0.54) | MEN1KMT2AKDM4EGAASMN1; SMN2 | |
| SCHEMBL6423856 | 0.72 | CYP1A2 (0.54) | MEN1KMT2AKDM4EGAASMN1; SMN2 | |
| SCHEMBL9543386 | 0.70 | ADRB2 (0.73) | KDM4EGAASMN1; SMN2TDP1ADRB3 | |
| SCHEMBL4467889 | 0.70 | ADRB2 (0.73) | KDM4EGAASMN1; SMN2TDP1ADRB3 | |
| SCHEMBL4467885 | 0.70 | ADRB2 (0.73) | KDM4EGAASMN1; SMN2TDP1ADRB3 | |
| SCHEMBL10594284 | 0.69 | ADRB2 (0.49) | MEN1KMT2AKDM4EGAASMN1; SMN2 |
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-5045567-A | Propanolamine derivatives having anti-diabetic effects | HOFFMANN-LA ROCHE INC. (US) | 1991-09-03 | — | — | US | disclosed |