Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE5A | O76074 | 2/20 | 0.66 |
| ▸ | TSHR | P16473 | 3/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.56 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.56 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.56 |
| ▸ | ELANE | P08246 | 1/20 | 0.56 |
| ▸ | PRTN3 | P24158 | 1/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.53 |
| ▸ | MEN1 | O00255 | 2/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.53 |
| ▸ | HPGD | P15428 | 3/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.53 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.53 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.52 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 2/20 | 0.52 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 2/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL6349071 | 0.89 | PDE5A (0.55) | PDE5ATSHRCYP1A2CYP2D6CYP2C19 | |
| SCHEMBL6349070 | 0.89 | PDE5A (0.55) | PDE5ATSHRCYP1A2CYP2D6CYP2C19 | |
| SCHEMBL8039707 | 0.89 | MEN1 (0.55) | PDE5AKMT2AMEN1RAB9ANPC1 | |
| SCHEMBL19472685 | 0.87 | PDE5A (0.60) | PDE5ATSHRCYP1A2CYP2D6CYP2C19 | |
| SCHEMBL6348792 | 0.84 | PDE5A (0.51) | PDE5ATSHRCYP1A2CYP2D6CYP2C19 | |
| SCHEMBL6348793 | 0.84 | PDE5A (0.51) | PDE5ATSHRCYP1A2CYP2D6CYP2C19 | |
| SCHEMBL8037902 | 0.84 | PDE5A (0.62) | PDE5ATSHRCYP1A2CYP2C19KMT2A | |
| SCHEMBL8037922 | 0.84 | ALDH1A1 (0.50) | PDE5ATSHRKMT2AKDM4EALDH1A1 | |
| SCHEMBL8038289 | 0.84 | ALDH1A1 (0.50) | PDE5ATSHRKMT2AKDM4EALDH1A1 | |
| SCHEMBL6406657 | 0.84 | ALDH1A1 (0.50) | PDE5ATSHRKMT2AKDM4EALDH1A1 |
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-0806412-B1 | BENZENE DERIVATIVES | TEIJIN LTD (JP) | 2000-04-05 | — | — | EP | disclosed |