Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 1/20 | 0.37 |
| ▸ | PNMT | P11086 | 4/20 | 0.37 |
| ▸ | ADRA2A | P08913 | 3/20 | 0.37 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.37 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | CASP1 | P29466 | 1/20 | 0.34 |
| ▸ | CASP3 | P42574 | 1/20 | 0.34 |
| ▸ | CASP4 | P49662 | 1/20 | 0.34 |
| ▸ | CASP7 | P55210 | 1/20 | 0.34 |
| ▸ | CASP9 | P55211 | 1/20 | 0.34 |
| ▸ | CASP6 | P55212 | 1/20 | 0.34 |
| ▸ | AKR1B1 | P15121 | 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 | |
|---|---|---|---|---|
| SCHEMBL5555976 | 0.82 | ACHE (0.52) | HTTALDH1A1SMN1; SMN2ACHEPNMT | |
| SCHEMBL2487541 | 0.81 | TDP1 (0.49) | HTTALDH1A1SMN1; SMN2GAAL3MBTL1 | |
| SCHEMBL5562474 | 0.78 | ESPL1 (0.40) | HTTSMN1; SMN2ACHEADRA2AL3MBTL1 | |
| SCHEMBL4507178 | 0.78 | CYP1A2 (0.46) | ALDH1A1L3MBTL1LMNAMAPTCASP1 | |
| SCHEMBL2487312 | 0.77 | BACE1 (0.33) | LMNA | |
| SCHEMBL5561087 | 0.76 | F2RL3 (0.43) | ALDH1A1L3MBTL1MAPTCASP1CASP3 | |
| SCHEMBL15577345 | 0.76 | CYP19A1 (0.33) | LMNA | |
| SCHEMBL15577409 | 0.76 | ALDH1A1 (0.39) | ALDH1A1SMN1; SMN2MAPT | |
| SCHEMBL5555736 | 0.75 | ESPL1 (0.38) | HTTALDH1A1SMN1; SMN2PNMTADRA2A | |
| SCHEMBL26621510 | 0.75 | L3MBTL1 (0.38) | HTTALDH1A1SMN1; SMN2ACHEL3MBTL1 |
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-1756112-A1 | PYRROLOBENZIMIDAZOLONES AND THEIR USE AS ANTIPROLIFERATIVE AGENTS | Boehringer Ingelheim International GmbH (DE) | 2007-02-28 | — | — | EP | disclosed |
| WO-2005111040-A1 | PYRROLOBENZIMIDAZOLONES AND THEIR USE AS ANTIPROLIFERATIVE AGENTS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2005-11-24 | — | — | WO | disclosed |