Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RIPK1 | Q13546 | 1/20 | 0.42 |
| ▸ | HHAT | Q5VTY9 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | CASP1 | P29466 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.39 |
| ▸ | HTR1A | P08908 | 1/20 | 0.39 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.39 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.39 |
| ▸ | DRD1 | P21728 | 1/20 | 0.39 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | HTR7 | P34969 | 1/20 | 0.39 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL38659451 | 0.79 | HSD11B1 (0.51) | RIPK1ALDH1A1NPC1RAB9APRMT5 | |
| SCHEMBL8296762 | 0.79 | HSD11B1 (0.51) | RIPK1ALDH1A1NPC1RAB9APRMT5 | |
| SCHEMBL31430923 | 0.78 | PRMT5 (0.55) | RIPK1ALDH1A1NPC1RAB9APRMT5 | |
| SCHEMBL29504572 | 0.78 | PRMT5 (0.55) | RIPK1ALDH1A1NPC1RAB9APRMT5 | |
| SCHEMBL29939211 | 0.77 | RIPK1 (0.41) | RIPK1HHATALDH1A1CASP1TSHR | |
| SCHEMBL29933840 | 0.77 | PIK3C3 (0.41) | RIPK1HHATALDH1A1CASP1NPC1 | |
| SCHEMBL5321655 | 0.76 | RIPK1 (0.40) | RIPK1HHATHTR2AHTR2CHTR7 | |
| SCHEMBL30398913 | 0.76 | CDK5 (0.40) | RIPK1HHATALDH1A1CASP1DRD3 | |
| SCHEMBL31276032 | 0.72 | NPC1 (0.38) | ALDH1A1CYP1A2CHRM2HTR1AADRA2A | |
| SCHEMBL20236634 | 0.72 | HTR1A (0.47) | HHATALDH1A1CASP1HTR1AHTR2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-116096719-A | Pyridazinylamino derivatives as ALK5 inhibitors | 奇斯药制品公司 | 2023-05-09 | — | — | CN | disclosed |