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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP1 known ✓ | P03956 | 1/20 | 0.33 |
| ▸ | MMP8 known ✓ | P22894 | 1/20 | 0.33 |
| ▸ | MMP13 known ✓ | P45452 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 2/20 | 0.42 |
| ▸ | GRIA4 | P48058 | 1/20 | 0.41 |
| ▸ | STAT3 | P40763 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 4/20 | 0.36 |
| ▸ | CA9 | Q16790 | 2/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | CA1 | P00915 | 3/20 | 0.34 |
| ▸ | GBA1 | P04062 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | CNR2 | P34972 | 2/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | BCHE | P06276 | 1/20 | 0.34 |
| ▸ | MMP2 | P08253 | 1/20 | 0.33 |
| ▸ | MMP9 | P14780 | 1/20 | 0.33 |
| ▸ | CNR1 | P21554 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL11041736 | 0.93 | GRIA4 (0.45) | ACHEGRIA4STAT3CA2CA9 | |
| Alcohol SCHEMBL11040135 | 0.85 | GRIA4 (0.32) | GRIA4STAT3ALDH1A1TSHR | |
| SCHEMBL11857239 | 0.81 | CA1 (0.40) | GRIA4CA2ALDH1A1CA1KMT2A | |
| Alcohol SCHEMBL11044424 | 0.81 | FFAR1 (0.33) | ACHEGRIA4CA2CA9ALDH1A1 | |
| SCHEMBL11040137 | 0.79 | GRIA4 (0.34) | ACHEGRIA4STAT3CA2CA1 | |
| SCHEMBL11958126 | 0.78 | CA1 (0.39) | GRIA4CA2CA9ALDH1A1CA1 | |
| SCHEMBL5877993 | 0.78 | PLCG1 (0.38) | GRIA4ALDH1A1KMT2AGAAMMP1 | |
| SCHEMBL5877986 | 0.78 | PLCG1 (0.38) | GRIA4ALDH1A1KMT2AGAAMMP1 | |
| SCHEMBL18359541 | 0.78 | PTGES2 (0.40) | GRIA4CA2CA9CA12ALDH1A1 | |
| SCHEMBL5878353 | 0.78 | PLCG1 (0.38) | GRIA4ALDH1A1KMT2AGAAMMP1 |
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-4490165-A | Meta-(phenylalkoxy)phenyl-N-methoxy-N-methylurea compounds, methods for preparing same and herbicidal use thereof | AMERICAN CYANAMID COMPANY (US) | 1984-12-25 | — | — | US | disclosed |
| US-4308213-A | Meta-(phenylalkoxy)phenyl-N-methoxy-N-methylurea compounds | AMERICAN CYANAMID COMPANY (US) | 1981-12-29 | — | — | US | disclosed |