Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.56 |
| ▸ | PAX8 | Q06710 | 4/20 | 0.55 |
| ▸ | POLB | P06746 | 1/20 | 0.55 |
| ▸ | LMNA | P02545 | 2/20 | 0.54 |
| ▸ | F2 | P00734 | 2/20 | 0.51 |
| ▸ | BRD1 | O95696 | 1/20 | 0.51 |
| ▸ | BRPF1 | P55201 | 1/20 | 0.51 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.49 |
| ▸ | PGR | P06401 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | PKM | P14618 | 1/20 | 0.49 |
| ▸ | PPARG | P37231 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | AR | P10275 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL6638828 | 0.85 | F2 (0.58) | F2ALDH1A1PKMPPARGHTT | |
| SCHEMBL6639365 | 0.84 | F2 (0.68) | SMN1; SMN2PAX8POLBLMNAF2 | |
| SCHEMBL8027058 | 0.81 | F2 (0.70) | SMN1; SMN2PAX8POLBLMNAF2 | |
| SCHEMBL6637025 | 0.80 | PAX8 (0.64) | SMN1; SMN2PAX8POLBLMNAF2 | |
| Pyrrole SCHEMBL6782101 | 0.78 | HTR2C (0.51) | SMN1; SMN2HDAC6PPARGNPC1RAB9A | |
| SCHEMBL6782097 | 0.78 | HTR2C (0.50) | SMN1; SMN2LMNAHDAC6ALDH1A1PPARG | |
| SCHEMBL6635871 | 0.76 | BRPF1 (0.48) | SMN1; SMN2PAX8POLBLMNAF2 | |
| SCHEMBL6636886 | 0.76 | BRPF1 (0.52) | SMN1; SMN2PAX8POLBLMNAF2 | |
| SCHEMBL6638614 | 0.74 | F2 (0.43) | SMN1; SMN2PAX8POLBLMNAF2 | |
| SCHEMBL8032270 | 0.74 | F2 (0.72) | SMN1; SMN2PAX8POLBLMNAF2 |
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 |