Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | GLA | P06280 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | THPO | P40225 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | CREBBP | Q92793 | 2/20 | 0.36 |
| ▸ | BRD4 | O60885 | 1/20 | 0.36 |
| ▸ | PDE4A | P27815 | 2/20 | 0.35 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.35 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL10699079 | 0.87 | HTT (0.39) | KDM4EALDH1A1GAAGLAHPGD | |
| SCHEMBL10695178 | 0.86 | KDM4E (0.38) | KDM4EALDH1A1HPGDMEN1KMT2A | |
| SCHEMBL10691679 | 0.84 | KDM4E (0.45) | KDM4EALDH1A1GAAGLAHPGD | |
| SCHEMBL10696706 | 0.80 | ALDH1A1 (0.41) | KDM4EALDH1A1GAAHPGDSMN1; SMN2 | |
| SCHEMBL10697092 | 0.79 | CREBBP (0.36) | KDM4EALDH1A1MEN1KMT2ARAB9A | |
| SCHEMBL10694302 | 0.78 | KDM4E (0.43) | KDM4EALDH1A1GAAGLAHPGD | |
| SCHEMBL10699175 | 0.73 | AURKA (0.38) | KDM4EALDH1A1GAAHPGDTSHR | |
| SCHEMBL10698582 | 0.72 | CYP1A2 (0.41) | KDM4EALDH1A1GAAGLAHPGD | |
| SCHEMBL10704063 | 0.72 | KDM4E (0.40) | KDM4EALDH1A1GAAGLAHPGD | |
| SCHEMBL10698674 | 0.72 | KDM4E (0.34) | KDM4EALDH1A1HPGDCYP3A4CYP2C19 |
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 |