Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADH1B | P00325 | 3/20 | 0.46 |
| ▸ | ADH1A | P07327 | 3/20 | 0.46 |
| ▸ | ADH7 | P40394 | 3/20 | 0.46 |
| ▸ | ADH1C | P00326 | 2/20 | 0.46 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.45 |
| ▸ | ADH4 | P08319 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 3/20 | 0.38 |
| ▸ | CES1 | P23141 | 2/20 | 0.36 |
| ▸ | CES2 | O00748 | 1/20 | 0.36 |
| ▸ | FAAH | O00519 | 3/20 | 0.34 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL16174872 | 0.77 | ADH1B (0.48) | ADH1BADH1AADH7ADH1CEPHX1 | |
| SCHEMBL28954639 | 0.75 | TSHR (0.60) | TSHRFAAHTRPV1TP53 | |
| SCHEMBL4244087 | 0.71 | CES1 (0.47) | TSHRCES1CES2ALDH1A1TP53 | |
| SCHEMBL16174964 | 0.71 | HAO1 (0.52) | ADH1BADH1AADH7ADH1CEPHX1 | |
| SCHEMBL28954640 | 0.71 | TSHR (0.67) | TSHRFAAHTRPV1TP53 | |
| SCHEMBL28954671 | 0.71 | TSHR (0.67) | TSHRFAAHTRPV1TP53 | |
| SCHEMBL4615246 | 0.71 | TSHR (0.67) | TSHRFAAHTRPV1TP53 | |
| SCHEMBL21413128 | 0.70 | FAAH (0.39) | TSHRCES1CES2FAAHALDH1A1 | |
| SCHEMBL16175303 | 0.69 | HAO1 (0.55) | ADH1BADH1AADH7ADH1CEPHX1 | |
| Ammonia Solution, Strong SCHEMBL2638345 | 0.69 | CES1 (0.45) | TSHRCES1CES2ALDH1A1TP53 |
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-5332780-A | Resin blend with groups reactive with amino groups, graft copolymers and thermoplasstic resins | DAI-ICHI KOGYO SEIYAKU CO., LTD. (JP) | 1994-07-26 | — | — | US | disclosed |