Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | PTGDR2 | Q9Y5Y4 | 2/20 | 0.41 |
| ▸ | PDE1C | Q14123 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | PDE9A | O76083 | 1/20 | 0.39 |
| ▸ | PTGES2 | Q9H7Z7 | 3/20 | 0.38 |
| ▸ | PTGES | O14684 | 1/20 | 0.38 |
| ▸ | AR | P10275 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.37 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.37 |
| ▸ | MDM2 | Q00987 | 2/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL20021094 | 0.88 | MEN1 (0.46) | MEN1KMT2AKDM4EPTGDR2PDE1C | |
| SCHEMBL20021131 | 0.85 | PTGDR2 (0.47) | MEN1KMT2AKDM4EPTGDR2LMNA | |
| SCHEMBL3297264 | 0.73 | CYP3A4 (0.42) | MEN1KMT2APTGDR2PTGES2PTGES | |
| SCHEMBL252857 | 0.73 | PTGES2 (0.39) | MEN1KMT2AKDM4EPTGDR2PDE1C | |
| SCHEMBL252858 | 0.73 | PTGES2 (0.39) | MEN1KMT2AKDM4EPTGDR2PDE1C | |
| SCHEMBL3312482 | 0.73 | PTGDR2 (0.40) | MEN1KMT2AKDM4EPTGDR2PTGES2 | |
| SCHEMBL15182599 | 0.73 | PTGES2 (0.41) | MEN1KMT2AKDM4EPTGDR2PTGES2 | |
| SCHEMBL10284225 | 0.68 | KDM4E (0.44) | MEN1KMT2AKDM4EPTGDR2LMNA | |
| SCHEMBL20021077 | 0.67 | CNR2 (0.44) | KMT2AKDM4EPTGDR2GAAHPGD | |
| SCHEMBL30783430 | 0.66 | KMT2A (0.70) | MEN1KMT2AKDM4ELMNAGAA |
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-2588455-B1 | 2-QUINOLINYL-ACETIC ACID DERIVATIVES AS HIV ANTIVIRAL COMPOUNDS | GILEAD SCIENCES INC (US) | 2018-04-04 | — | — | EP | disclosed |