Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 5/20 | 0.38 |
| ▸ | TDO2 | P48775 | 2/20 | 0.38 |
| ▸ | VDR | P11473 | 5/20 | 0.36 |
| ▸ | GSK3B | P49841 | 1/20 | 0.34 |
| ▸ | PGR | P06401 | 1/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | NQO2 | P16083 | 1/20 | 0.32 |
| ▸ | PDE5A | O76074 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | CCKBR | P32239 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9832943 | 0.83 | MAPT (0.39) | IDO1TDO2VDRPOLBMAPT | |
| SCHEMBL5181107 | 0.81 | PGR (0.48) | IDO1GSK3BPGRTP53POLB | |
| SCHEMBL9834483 | 0.79 | IDO1 (0.35) | IDO1TDO2PGRTP53POLB | |
| SCHEMBL10470471 | 0.79 | IDO1 (0.41) | IDO1GSK3BPGRTP53POLB | |
| SCHEMBL10472852 | 0.75 | MAPT (0.42) | IDO1PGRTP53MAPTNQO2 | |
| SCHEMBL9832316 | 0.74 | ALDH1A1 (0.47) | IDO1TDO2GSK3BPGRTP53 | |
| Hydrochloric Acid SCHEMBL10376017 | 0.73 | MAOB (0.40) | TP53MAPT | |
| SCHEMBL2983658 | 0.73 | IDO1 (0.61) | IDO1TDO2GSK3BMAPTGAA | |
| SCHEMBL9834478 | 0.72 | CHRNB2 (0.40) | IDO1TDO2ESR2TP53POLB | |
| SCHEMBL9833587 | 0.71 | KDM4E (0.41) | IDO1TDO2GSK3BPGRTP53 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0161632-B1 | PYRROLO-BENZIMIDAZOLES, PROCESS FOR THEIR PREPARATION, MEDICAMENTS CONTAINING THEM AND INTERMEDIATES | Roche Diagnostics GmbH (DE) | 1991-04-10 | — | — | EP | disclosed |
| US-4963686-A | INTERMEDIATES FOR INOTROPIC AGENTS | BOEHRINGER MANNHEIM GMBH (DE) | 1990-10-16 | — | — | US | disclosed |
| CN-85103724-B | Process for preparing pyrrolobenzimidazoles | 曼海姆伯灵格股份公司 | 1988-07-06 | — | — | CN | disclosed |
| CN-85103724-A | The method for preparing novel pyrrolo-benzoglyoxaline | — | 1986-07-02 | — | — | CN | disclosed |
| EP-0161632-A2 | Pyrrolo-benzimidazoles, process for their preparation, medicaments containing them and intermediates | Roche Diagnostics GmbH (DE) | 1985-11-21 | — | — | EP | disclosed |