Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | F2 | P00734 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 4/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.47 |
| ▸ | PKLR | P30613 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | BRPF1 | P55201 | 5/20 | 0.46 |
| ▸ | BRD4 | O60885 | 3/20 | 0.45 |
| ▸ | BRD1 | O95696 | 3/20 | 0.45 |
| ▸ | BRD9 | Q9H8M2 | 2/20 | 0.45 |
| ▸ | BRPF3 | Q9ULD4 | 2/20 | 0.45 |
| ▸ | BRD7 | Q9NPI1 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | NTSR1 | P30989 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL8026334 | 0.92 | F2 (0.55) | F2MEN1KMT2APKLRCYP1A2 | |
| Hydrochloric Acid SCHEMBL6634654 | 0.84 | F2 (0.69) | F2MEN1KMT2APKLRCYP1A2 | |
| SCHEMBL6637767 | 0.82 | F2 (0.49) | F2MEN1KMT2APKLRBRD4 | |
| SCHEMBL8026354 | 0.81 | F2 (0.74) | F2MEN1KMT2APKLRCYP1A2 | |
| SCHEMBL6636395 | 0.81 | F2 (0.58) | F2MEN1KMT2APKLRCYP1A2 | |
| SCHEMBL6634709 | 0.81 | F2 (0.57) | F2MEN1KMT2APKLRCYP1A2 | |
| SCHEMBL7985209 | 0.79 | F2 (0.60) | F2MEN1KMT2APKLRCYP1A2 | |
| SCHEMBL8029757 | 0.79 | F2 (0.55) | F2MEN1KMT2APKLRCYP1A2 | |
| SCHEMBL7353803 | 0.79 | PKLR (0.47) | F2MEN1KMT2APKLRBRD4 | |
| SCHEMBL6633880 | 0.78 | F2 (0.49) | F2MEN1KMT2APKLRBRD4 |
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-1100795-B1 | DISUBSTITUTED BICYCLIC HETEROCYCLES HAVING, IN PARTICULAR, A THROMBIN INHIBITIVE EFFECT | BOEHRINGER INGELHEIM PHARMA (DE) | 2004-06-09 | — | — | EP | disclosed |
| US-6121308-A | INDOLE AND BENZIMIDAZOLE ANTITHROMBOTIC COMPOUNDS, SUCH AS 1-METHYL-2-(N-(4-AMIDINOPHENYL)-AMINOMETHYL)-5-(N-(HYDROXYCARBONYLMETHYL) -QUINOLINE-8-SULPHONYLAMINO)-INDOLE | BOEHRINGER INGELHEIM KG (DE) | 2000-09-19 | — | — | US | disclosed |