Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 2/20 | 0.58 |
| ▸ | HTR2A | P28223 | 1/20 | 0.58 |
| ▸ | HTR2B | P41595 | 1/20 | 0.58 |
| ▸ | KDM1A | O60341 | 12/20 | 0.57 |
| ▸ | KDM1B | Q8NB78 | 2/20 | 0.57 |
| ▸ | MAOB | P27338 | 8/20 | 0.48 |
| ▸ | MAOA | P21397 | 7/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.48 |
| ▸ | CYP2B6 | P20813 | 3/20 | 0.48 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | HTR1A | P08908 | 1/20 | 0.48 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.48 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.48 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.48 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL7094448 | 1.00 | HTR2C (0.58) | HTR2CHTR2AHTR2BKDM1AKDM1B | |
| SCHEMBL7094447 | 1.00 | HTR2C (0.58) | HTR2CHTR2AHTR2BKDM1AKDM1B | |
| SCHEMBL25058901 | 0.83 | HTR2C (0.59) | HTR2CHTR2AHTR2BKDM1ATAAR1 | |
| SCHEMBL1643784 | 0.79 | KDM1A (0.47) | HTR2CHTR2AHTR2BKDM1AKDM1B | |
| SCHEMBL1643791 | 0.79 | KDM1A (0.47) | HTR2CHTR2AHTR2BKDM1AKDM1B | |
| SCHEMBL5004304 | 0.79 | KDM1A (0.47) | HTR2CHTR2AHTR2BKDM1AKDM1B | |
| SCHEMBL3841365 | 0.79 | KDM1A (0.47) | HTR2CHTR2AHTR2BKDM1AKDM1B | |
| SCHEMBL1643782 | 0.79 | KDM1A (0.47) | HTR2CHTR2AHTR2BKDM1AKDM1B | |
| SCHEMBL15064669 | 0.77 | HTR2C (0.45) | HTR2CHTR2AHTR2BKDM1AMAOB | |
| SCHEMBL807474 | 0.77 | HTR2C (0.45) | HTR2CHTR2AHTR2BKDM1AMAOB |
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-6251910-B1 | 1,2,3-triazolo[4,5-d]pyrimidines as P2T receptor antagonists | ASTRAZENECA UK LIMITED (GB) | 2001-06-26 | — | — | US | disclosed |