Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 12/20 | 0.48 |
| ▸ | ESR2 | Q92731 | 8/20 | 0.48 |
| ▸ | AR | P10275 | 5/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | RECQL | P46063 | 1/20 | 0.46 |
| ▸ | IDO1 | P14902 | 1/20 | 0.44 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | ARG1 | P05089 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL3962037 | 0.83 | ALDH1A1 (0.54) | MAPTCYP3A4TSHRRECQLIDO1 | |
| SCHEMBL29642426 | 0.83 | ARG1 (0.59) | TP53MAPTCYP3A4TSHRRECQL | |
| SCHEMBL347616 | 0.83 | ARG1 (0.59) | TP53MAPTCYP3A4TSHRRECQL | |
| SCHEMBL28698738 | 0.82 | PDE10A (0.47) | ESR1ESR2ARTP53TDP1 | |
| SCHEMBL11604188 | 0.81 | ALDH1A1 (0.53) | ESR1ESR2ARTP53TDP1 | |
| Hydrochloric Acid SCHEMBL1825913 | 0.81 | ARG1 (0.57) | MAPTIDO1ALDH1A1ARG1 | |
| SCHEMBL1803111 | 0.80 | ALDH1A1 (0.55) | TDP1MAPTCYP3A4TSHRRECQL | |
| SCHEMBL30536438 | 0.80 | ALDH1A1 (0.55) | TDP1MAPTCYP3A4TSHRRECQL | |
| SCHEMBL4466574 | 0.80 | ALDH1A1 (0.56) | ESR1ESR2ARTP53TDP1 | |
| SCHEMBL25856355 | 0.79 | IDO1 (0.46) | ESR1ESR2ARTP53TDP1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1332942-C | Sulfonylamino-acetic acid derivatives and their use as orexin receptor antagonists | ACTELION PHARMACEUTICALS LTD (CH) | 2007-08-22 | — | — | CN | disclosed |
| CN-1703397-A | Sulfonylamino-acetic acid derivatives and their use as orexin receptor antagonists | ACTELION PHARMACEUTICALS LTD (CH) | 2005-11-30 | — | — | CN | disclosed |
| EP-0920853-B1 | Hair dye compositions | P & G CLAIROL INC (US) | 2004-01-21 | — | — | EP | disclosed |
| EP-0920853-A1 | Hair dye compositions | Bristol-Myers Squibb Company (US) | 1999-06-09 | — | — | EP | disclosed |