Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TYMS | P04818 | 4/20 | 0.61 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | BRD4 | O60885 | 1/20 | 0.39 |
| ▸ | KLK7 | P49862 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.37 |
| ▸ | PTPRB | P23467 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 3/20 | 0.37 |
| ▸ | ALPL | P05186 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 5/20 | 0.36 |
| ▸ | CASP1 | P29466 | 3/20 | 0.36 |
| ▸ | CASP7 | P55210 | 3/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | CDK5 | Q00535 | 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 | |
|---|---|---|---|---|
| SCHEMBL9506816 | 0.95 | TYMS (0.62) | TYMSMEN1KMT2ABRD4KLK7 | |
| SCHEMBL9704015 | 0.90 | TYMS (0.67) | TYMSMEN1KMT2ABRD4KLK7 | |
| SCHEMBL9701868 | 0.86 | TYMS (0.76) | TYMSBRD4KLK7KDM4EALDH1A1 | |
| SCHEMBL9703980 | 0.84 | TYMS (0.62) | TYMSBRD4KLK7KDM4EALDH1A1 | |
| SCHEMBL9080571 | 0.68 | TYMS (0.79) | TYMSMEN1KMT2ABRD4KLK7 | |
| SCHEMBL9702076 | 0.66 | TYMS (0.75) | TYMSMEN1KMT2ABRD4KLK7 | |
| SCHEMBL9080093 | 0.65 | TYMS (1.00) | TYMSMEN1KMT2ABRD4KLK7 | |
| SCHEMBL9504689 | 0.62 | ALDH1A1 (0.47) | MEN1KMT2ABRD4KDM4EALDH1A1 | |
| SCHEMBL29774550 | 0.60 | TYMS (0.48) | TYMSMEN1KMT2AKDM4EALDH1A1 | |
| SCHEMBL22533183 | 0.60 | TYMS (0.48) | TYMSMEN1KMT2AKDM4EALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1992005153-A1 | ANTIPROLIFERATIVE SUBSTITUTED NAPHTHALENE COMPOUNDS | AGOURON PHARMACEUTICALS, INC. (US) | 1992-04-02 | — | — | WO | disclosed |