Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 8/20 | 0.56 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | BRD4 | O60885 | 1/20 | 0.36 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.35 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.35 |
| ▸ | CREBBP | Q92793 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL20100593 | 0.81 | ALDH1A1 (0.46) | PARP1GAAALDH1A1KDM4EHSD17B10 | |
| SCHEMBL20100677 | 0.81 | ALDH1A1 (0.43) | PARP1GAAALDH1A1KDM4EKMT2A | |
| SCHEMBL2485535 | 0.73 | ALDH1A1 (0.50) | PARP1GAAALDH1A1 | |
| SCHEMBL13589780 | 0.73 | ALDH1A1 (0.50) | PARP1GAAALDH1A1MEN1KMT2A | |
| SCHEMBL21570172 | 0.72 | CHRM3 (0.41) | PARP1GAAALDH1A1KDM4EMEN1 | |
| SCHEMBL20100285 | 0.71 | PARP1 (0.38) | PARP1GAAALDH1A1MAPTKDM4E | |
| SCHEMBL20100606 | 0.71 | RPS6KA3 (0.51) | ALDH1A1MAPTKDM4EMEN1KMT2A | |
| SCHEMBL10446487 | 0.70 | ALDH1A1 (0.47) | PARP1GAAALDH1A1KDM4E | |
| SCHEMBL20100521 | 0.69 | ALDH1A1 (0.50) | PARP1GAAALDH1A1GLA | |
| SCHEMBL13589774 | 0.69 | ALDH1A1 (0.50) | PARP1GAAALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018079628-A1 | PYRROLE DERIVATIVE WITH FUSED RING AND PHARMACEUTICAL USE THEREOF | 大日本住友製薬株式会社 | 2018-05-03 | — | — | WO | disclosed |