Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 5/20 | 0.61 |
| ▸ | DRD3 | P35462 | 5/20 | 0.61 |
| ▸ | HTR1A | P08908 | 4/20 | 0.61 |
| ▸ | DRD4 | P21917 | 4/20 | 0.61 |
| ▸ | HTR2A | P28223 | 4/20 | 0.61 |
| ▸ | HTR2C | P28335 | 4/20 | 0.61 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.58 |
| ▸ | MAPT | P10636 | 1/20 | 0.58 |
| ▸ | RAD52 | P43351 | 1/20 | 0.58 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.49 |
| ▸ | HTR6 | P50406 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 4/20 | 0.44 |
| ▸ | RAB9A | P51151 | 4/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | CASP1 | P29466 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL4485868 | 0.85 | MAPT (0.61) | DRD2DRD3HTR1ADRD4HTR2A | |
| SCHEMBL24478309 | 0.83 | DRD2 (0.55) | DRD2DRD3HTR1ADRD4HTR2A | |
| SCHEMBL14554255 | 0.83 | HTR1A (0.47) | DRD2DRD3HTR1ADRD4HTR2A | |
| SCHEMBL14228541 | 0.83 | HTR1A (0.51) | DRD2DRD3HTR1ADRD4HTR2A | |
| SCHEMBL4492340 | 0.83 | MAPT (0.60) | MAPTSIGMAR1CYP2D6NPC1RAB9A | |
| SCHEMBL8427926 | 0.81 | ALDH1A1 (0.49) | DRD2DRD3HTR1ADRD4HTR2A | |
| SCHEMBL12142119 | 0.81 | DRD2 (0.62) | DRD2DRD3HTR1ADRD4HTR2A | |
| SCHEMBL17543217 | 0.80 | ALDH1A3 (0.42) | DRD2DRD3HTR1ADRD4HTR2A | |
| SCHEMBL23544876 | 0.80 | MAPT (0.54) | KDM4EMAPTPOLBCYP2D6ALDH1A1 | |
| SCHEMBL17642835 | 0.79 | DRD2 (0.57) | DRD2DRD3HTR1ADRD4HTR2A |
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-RE46511-E1 | Fused pyrimidine derivatives for inhibition of tyrosine kinase activity | HANMI SCIENCE CO., LTD. (KR) | 2017-08-15 | — | — | US | disclosed |