Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | F2 | P00734 | 7/20 | 0.57 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | F10 | P00742 | 1/20 | 0.35 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | ST14 | Q9Y5Y6 | 1/20 | 0.34 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.34 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.34 |
| ▸ | STAT3 | P40763 | 1/20 | 0.34 |
| ▸ | PTPRS | Q13332 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8026857 | 0.93 | F2 (0.56) | F2PKMTSHRGAAALDH1A1 | |
| SCHEMBL6634784 | 0.92 | F2 (0.67) | F2PKMALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL6636555 | 0.89 | F2 (0.58) | F2PKMTSHRGAAALDH1A1 | |
| Hydrochloric Acid SCHEMBL6636009 | 0.89 | F2 (0.57) | F2PKMTSHRGAAALDH1A1 | |
| SCHEMBL6637732 | 0.88 | F2 (0.43) | F2PKMTSHRGAAALDH1A1 | |
| Hydrochloric Acid SCHEMBL8026788 | 0.88 | F2 (0.54) | F2PKMTSHRGAAALDH1A1 | |
| SCHEMBL6642022 | 0.85 | F2 (0.59) | F2PKMTSHRGAAALDH1A1 | |
| SCHEMBL6635301 | 0.85 | F2 (0.60) | F2TSHRGAAALDH1A1MAPT | |
| Hydrochloric Acid SCHEMBL8026417 | 0.84 | F2 (0.66) | F2PKMALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL7389757 | 0.84 | F2 (0.57) | F2PKMTSHRGAAALDH1A1 |
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 |