Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 6/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | TNKS | O95271 | 5/20 | 0.40 |
| ▸ | TNKS2 | Q9H2K2 | 5/20 | 0.40 |
| ▸ | CCR6 | P51684 | 1/20 | 0.38 |
| ▸ | METAP2 | P50579 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.36 |
| ▸ | KDM4A | O75164 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.36 |
| ▸ | HIF1AN | Q9NWT6 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 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 | |
|---|---|---|---|---|
| SCHEMBL18106120 | 0.74 | PARP1 (0.50) | PARP1KDM4ECYP1A2CYP2D6CYP2C9 | |
| SCHEMBL6080384 | 0.73 | KDM4E (0.46) | PARP1KDM4ECYP1A2CYP2D6CYP2C9 | |
| SCHEMBL11871238 | 0.72 | KMT2A (0.45) | PARP1KDM4ECYP1A2CYP2D6CYP2C9 | |
| SCHEMBL11879927 | 0.72 | ESR1 (0.50) | PARP1KDM4ECYP1A2CYP2D6CYP2C9 | |
| SCHEMBL6080749 | 0.71 | CYP1A2 (0.54) | PARP1KDM4ECYP1A2CYP2D6CYP2C9 | |
| SCHEMBL6079746 | 0.71 | PARP1 (0.48) | PARP1KDM4ECYP1A2CYP2D6CYP2C9 | |
| SCHEMBL13313366 | 0.68 | CYP1A2 (0.64) | PARP1KDM4ECYP1A2CYP2D6CYP2C9 | |
| SCHEMBL6080558 | 0.66 | KDM4E (0.40) | PARP1KDM4ECYP1A2CYP2D6CYP2C9 | |
| SCHEMBL6079815 | 0.66 | CA12 (0.45) | PARP1KDM4ECYP1A2CYP2D6CYP2C9 | |
| SCHEMBL6080957 | 0.65 | PDE10A (0.52) | PARP1KDM4ETNKSTNKS2L3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| US-20110160503-A1 | PROCESS FOR PREPARING A SUPPORTED CATALYST BASED ON Ni AND A METAL FROM GROUP IB, FOR THE SELECTIVE HYDROGENATION OF POLYUNSATURATED HYDROCARBONS | IFP Energies Nouvelles (FR) | 2011-06-30 | — | — | US | disclosed |