Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.37 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.36 |
| ▸ | AURKA | O14965 | 2/20 | 0.33 |
| ▸ | AURKB | Q96GD4 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 6/20 | 0.32 |
| ▸ | POLB | P06746 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 3/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.31 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.30 |
| ▸ | SRC | P12931 | 1/20 | 0.30 |
| ▸ | CDK2 | P24941 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL10697456 | 0.83 | MEN1 (0.40) | ALDH1A1L3MBTL1AURKAAURKBHPGD | |
| SCHEMBL10373869 | 0.78 | PGR (0.39) | ALDH1A1L3MBTL1HSD11B1HPGDPOLB | |
| SCHEMBL10701198 | 0.77 | TNKS2 (0.44) | ALDH1A1L3MBTL1HSD11B1AURKAAURKB | |
| SCHEMBL10696440 | 0.76 | MEN1 (0.40) | ALDH1A1L3MBTL1AURKAAURKBHPGD | |
| SCHEMBL10696613 | 0.74 | AURKA (0.40) | ALDH1A1L3MBTL1AURKAAURKBHPGD | |
| SCHEMBL10697356 | 0.73 | MEN1 (0.40) | ALDH1A1HPGDKDM4EHSD17B10MEN1 | |
| SCHEMBL10698519 | 0.72 | CNR1 (0.41) | ALDH1A1AURKAAURKBLMNAMEN1 | |
| SCHEMBL10698153 | 0.72 | AURKA (0.38) | AURKAAURKBCHEK1SRCCDK2 | |
| SCHEMBL10700532 | 0.72 | AURKA (0.43) | ALDH1A1AURKAAURKBLMNAMEN1 | |
| SCHEMBL10699508 | 0.72 | AURKA (0.39) | AURKAAURKBCHEK1SRCCDK2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0268178-A1 | Pyrrolo-benzimidazoles, medicaments containing these compounds and process for their preparation | Dr. Karl Thomae GmbH (DE) | 1988-05-25 | — | — | EP | disclosed |