Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.47 |
| ▸ | S1PR5 | Q9H228 | 6/20 | 0.46 |
| ▸ | TIPARP | Q7Z3E1 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | ABHD6 | Q9BV23 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.42 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.42 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.42 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.41 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.41 |
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL21659367 | 0.85 | ESR2 (0.47) | HRH3S1PR5ABHD6SCN9APTGDR2 | |
| SCHEMBL30641865 | 0.84 | DRD2 (0.51) | HSD17B10ABHD6KMT2ANOTUMKDM4E | |
| SCHEMBL16269151 | 0.83 | PTGDR2 (0.53) | S1PR5HPGDTSHRSMN1; SMN2HSD17B10 | |
| SCHEMBL28539714 | 0.76 | ESR1 (0.52) | HRH3HPGDTSHRSMN1; SMN2HSD17B10 | |
| SCHEMBL28533346 | 0.76 | HRH3 (0.57) | HRH3HPGDTSHRSMN1; SMN2HSD17B10 | |
| SCHEMBL22319858 | 0.76 | ABHD6 (0.55) | HRH3S1PR5HPGDTSHRSMN1; SMN2 | |
| SCHEMBL22319832 | 0.76 | ABHD6 (0.50) | HRH3S1PR5HPGDTSHRSMN1; SMN2 | |
| SCHEMBL29168677 | 0.76 | DRD1 (0.40) | HRH3HPGDTSHRSMN1; SMN2HSD17B10 | |
| SCHEMBL30726807 | 0.75 | ALDH1A1 (0.51) | HPGDSMN1; SMN2ABHD6MEN1KMT2A | |
| SCHEMBL22319878 | 0.75 | ABHD6 (0.54) | HRH3S1PR5HPGDTSHRSMN1; SMN2 |
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-112469722-A | Pyrazolo-triazolopyrimidine derivatives as A2A receptor antagonists | 百济神州有限公司 | 2021-03-09 | — | — | CN | disclosed |