Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 7/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.35 |
| ▸ | DRD4 | P21917 | 2/20 | 0.35 |
| ▸ | DRD3 | P35462 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | DRD1 | P21728 | 1/20 | 0.35 |
| ▸ | DRD5 | P21918 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.34 |
| ▸ | ACHE | P22303 | 1/20 | 0.34 |
| ▸ | HTR4 | Q13639 | 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 | |
|---|---|---|---|---|
| SCHEMBL9929042 | 0.81 | DRD2 (0.36) | DRD2ACHEHTR4 | |
| SCHEMBL9970971 | 0.77 | HPGD (0.32) | — | |
| SCHEMBL9928921 | 0.76 | ATM (0.42) | KMT2AMEN1LMNA | |
| SCHEMBL9970967 | 0.74 | HCRTR1 (0.35) | — | |
| SCHEMBL14753934 | 0.72 | IMPDH2 (0.48) | KDM4EHSD17B10 | |
| SCHEMBL14736962 | 0.70 | ALDH1A1 (0.37) | DRD2KMT2AHSD17B10MEN1LMNA | |
| SCHEMBL9928890 | 0.69 | IMPDH2 (0.34) | DRD2HSD17B10LMNA | |
| SCHEMBL14742470 | 0.69 | PIK3CD (0.35) | DRD2CYP1A2CYP2D6DRD4DRD3 | |
| SCHEMBL9929296 | 0.68 | HSD17B10 (0.40) | KDM4EHSD17B10 | |
| SCHEMBL9928807 | 0.68 | IMPDH2 (0.39) | KMT2AKDM4EHSD17B10MEN1LMNA |
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-3660016-A1 | N-(1-(SUBSTITUTED-PHENYL)ETHYL)-9H-PURIN-6-AMINES AS PI3K INHIBITORS | Incyte Holdings Corporation (US) | 2020-06-03 | — | — | EP | disclosed |