Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | MCHR1 | Q99705 | 4/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | HTR2C | P28335 | 1/20 | 0.34 |
| ▸ | HTR2B | P41595 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CASP1 | P29466 | 1/20 | 0.33 |
| ▸ | CASP7 | P55210 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | BRD4 | O60885 | 2/20 | 0.32 |
| ▸ | PPARD | Q03181 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL20030474 | 0.90 | USP2 (0.34) | KDM4EMCHR1ALDH1A1MEN1KMT2A | |
| SCHEMBL19906155 | 0.88 | EIF4EBP1 (0.34) | KDM4EMCHR1HTR2AHTR2CHTR2B | |
| SCHEMBL20030685 | 0.88 | KDM4E (0.33) | KDM4EMCHR1ALDH1A1MEN1KMT2A | |
| SCHEMBL19905935 | 0.84 | KDM4E (0.34) | KDM4EALDH1A1MEN1KMT2APTGDR2 | |
| SCHEMBL19905854 | 0.83 | MET (0.39) | KDM4EMCHR1MAPTHTR2AHTR2C | |
| SCHEMBL22506323 | 0.83 | PSIP1 (0.36) | CYP3A4BRD4EGLN1 | |
| SCHEMBL15342590 | 0.83 | PSIP1 (0.36) | CYP3A4BRD4EGLN1 | |
| SCHEMBL19905785 | 0.82 | KDM4E (0.38) | KDM4EMAPTALDH1A1MEN1KMT2A | |
| SCHEMBL19906079 | 0.82 | ACVR1B (0.40) | MCHR1MAPTHTR2AHTR2CHTR2B | |
| SCHEMBL19905852 | 0.82 | KDM4E (0.35) | KDM4EALDH1A1MEN1KMT2APTGDR2 |
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-3070081-B1 | BENZOTHIAZOL-6-YL ACETIC ACID DERIVATIVES AND THEIR USE FOR TREATING AN HIV INFECTION | GILEAD SCIENCES INC (US) | 2018-02-28 | — | — | EP | disclosed |