Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | CASP1 | P29466 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | CTNNB1 | P35222 | 2/20 | 0.34 |
| ▸ | WNT3A | P56704 | 2/20 | 0.34 |
| ▸ | HCRTR1 | O43613 | 10/20 | 0.34 |
| ▸ | HCRTR2 | O43614 | 10/20 | 0.34 |
| ▸ | PDE5A | O76074 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | PDE4A | P27815 | 1/20 | 0.33 |
| ▸ | PDE6C | P51160 | 1/20 | 0.33 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.33 |
| ▸ | PDE11A | Q9HCR9 | 1/20 | 0.33 |
| ▸ | PDE10A | Q9Y233 | 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 | |
|---|---|---|---|---|
| SCHEMBL4963781 | 0.90 | CTNNB1 (0.35) | KDM4EALDH1A1GAAHPGDCASP1 | |
| SCHEMBL4735946 | 0.85 | ELANE (0.40) | TSHRMAPK1KDM4EALDH1A1GAA | |
| SCHEMBL4962551 | 0.84 | CTNNB1 (0.35) | MAPK1ALDH1A1HPGDCTNNB1WNT3A | |
| SCHEMBL4965054 | 0.83 | HCRTR1 (0.32) | HCRTR1HCRTR2 | |
| SCHEMBL4961356 | 0.82 | HTT (0.43) | TSHRALDH1A1LMNAMEN1KMT2A | |
| SCHEMBL4738299 | 0.82 | HTT (0.46) | TSHRALDH1A1LMNAMEN1KMT2A | |
| SCHEMBL4963749 | 0.81 | GSK3B (0.35) | KDM4EALDH1A1HSD17B10CTNNB1WNT3A | |
| SCHEMBL4963521 | 0.80 | NPC1 (0.42) | ALDH1A1MEN1RAB9AKMT2ADRD4 | |
| SCHEMBL4964158 | 0.80 | NPC1 (0.36) | CTNNB1WNT3ACYP3A4MEN1RAB9A | |
| SCHEMBL4964361 | 0.79 | IDO1 (0.38) | MAPK1CTNNB1WNT3ARAB9A |
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-1904454-A2 | PROCESS FOR THE PRODUCTION OF INTERMADIATES FOR THE PREPARATION OF TRICYCLIC BENZIMIDAZOLES | Nycomed GmbH (DE) | 2008-04-02 | — | — | EP | disclosed |
| WO-2006136552-A2 | PROCESS FOR THE PRODUCTION OF INTERMADIATES FOR THE PREPARATION OF TRICYCLIC BENZIMIDAZOLES | NYCOMED GMBH (DE) | 2006-12-28 | — | — | WO | disclosed |