Known targets — ChEMBL curated mechanism
ABL1ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB2AGTR1BCL2BCL2A1BCL2L1BCL2L10BCL2L2BCRBRAFCHRM1CHRNA10CHRNA9DRD1DRD2DRD3DRD4DRD5EGFRF2FLT1FLT4GCKGHSRGNRHRGRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BHTR1AHTR1BHTR1DHTR2AHTR2CHTR3AIDH2KDRKITMAOBMCL1MTTPPP4HBPDGFRBPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PIKFYVEROCK1ROCK2SLC18A2SLC6A2SLC6A3SLC6A4TACR1TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8gyrAgyrBparCparEpol
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 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CA5A | P35218 | 1/20 | 0.33 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 3/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Alcohol SCHEMBL282048 | 0.93 | — | — | |
| Alcohol SCHEMBL17183875 | 0.93 | TSHR (0.50) | ALDH1A1TSHRCA2KDM4ECYP3A4 | |
| Alcohol SCHEMBL20295436 | 0.93 | TSHR (0.50) | ALDH1A1TSHRCA2KDM4ECYP3A4 | |
| Alcohol SCHEMBL21924398 | 0.89 | TSHR (0.46) | ALDH1A1TSHRCA2KDM4ECYP3A4 | |
| Alcohol SCHEMBL27681725 | 0.89 | — | — | |
| Dimethylamine SCHEMBL4531539 | 0.84 | — | — | |
| Dimethylamine SCHEMBL27659636 | 0.81 | — | — | |
| Dimethyl Sulfone SCHEMBL7886489 | 0.81 | — | — | |
| Sulfuric Acid SCHEMBL84046 | 0.81 | — | — | |
| Sulfuric Acid SCHEMBL21624984 | 0.81 | TSHR (0.55) | ALDH1A1TSHRCA2KDM4ECYP3A4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1507812-A1 | POLYURETHANE DISPERSIONS | Crompton Corporation (US) | 2005-02-23 | — | — | EP | disclosed |
| WO-2003099891-A1 | POLYURETHANE DISPERSIONS | CROMPTON CORPORATION (US) | 2003-12-04 | — | — | WO | disclosed |
| US-20030220463-A1 | Polyurethane dispersions | CROMPTON CORPORATION | 2003-11-27 | — | — | US | disclosed |