Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 5/20 | 0.39 |
| ▸ | BRD2 | P25440 | 1/20 | 0.39 |
| ▸ | TDO2 | P48775 | 1/20 | 0.37 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | IKBKB | O14920 | 1/20 | 0.35 |
| ▸ | CHUK | O15111 | 1/20 | 0.35 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | MLYCD | O95822 | 1/20 | 0.34 |
| ▸ | EDNRB | P24530 | 2/20 | 0.33 |
| ▸ | EDNRA | P25101 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 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 | |
|---|---|---|---|---|
| SCHEMBL6511644 | 0.85 | BRD4 (0.56) | BRD4BRD2TDO2ALOX5APEDNRB | |
| SCHEMBL6514108 | 0.81 | ALDH1A1 (0.40) | BRD4BRD2TDO2ALOX5APMEN1 | |
| SCHEMBL11929 | 0.81 | BRD4 (0.34) | BRD4ALOX5APMEN1KMT2ATRPV1 | |
| SCHEMBL18597730 | 0.80 | MEN1 (0.39) | MEN1KMT2ATRPV1LMNAEDNRB | |
| SCHEMBL6513072 | 0.79 | PTGS2 (0.56) | EDNRBEDNRACYP1A2CYP3A4CYP2C9 | |
| SCHEMBL6517910 | 0.78 | CA2 (0.54) | LMNAEDNRBEDNRACYP1A2CYP3A4 | |
| SCHEMBL1772573 | 0.75 | BRD4 (0.66) | BRD4BRD2MEN1KMT2ALMNA | |
| SCHEMBL27886960 | 0.75 | EDNRB (0.45) | MEN1KMT2ATRPV1EDNRBEDNRA | |
| SCHEMBL21105338 | 0.73 | BRD4 (0.68) | BRD4BRD2TDO2ALOX5APPTGS2 | |
| SCHEMBL25406124 | 0.73 | MEN1 (0.39) | BRD4BRD2MEN1KMT2ATRPV1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2483252-A2 | COMPOUNDS AS LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISTS | Amira Pharmaceuticals, Inc. (US) | 2012-08-08 | — | — | EP | disclosed |
| WO-2011041694-A2 | COMPOUNDS AS LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISTS | AMIRA PHARMACEUTICALS, INC. (US) | 2011-04-07 | — | — | WO | disclosed |