Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.35 |
| ▸ | PTGDR2 | Q9Y5Y4 | 7/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.33 |
| ▸ | CASP3 | P42574 | 1/20 | 0.32 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.32 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.32 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.31 |
| ▸ | CA12 | O43570 | 1/20 | 0.31 |
| ▸ | CA9 | Q16790 | 1/20 | 0.31 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.31 |
| ▸ | SREBF2 | Q12772 | 1/20 | 0.30 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL19906266 | 0.89 | KDM4E (0.33) | KDM4EPTGDR2ALDH1A1MEN1KMT2A | |
| SCHEMBL19905862 | 0.87 | KDM4E (0.37) | KDM4EPTGDR2ALDH1A1MEN1KMT2A | |
| SCHEMBL19906047 | 0.86 | KDM4E (0.35) | KDM4EPTGDR2ALDH1A1MEN1KMT2A | |
| SCHEMBL19906240 | 0.86 | PTGDR2 (0.38) | KDM4EPTGDR2ALDH1A1MEN1KMT2A | |
| SCHEMBL19905838 | 0.85 | PTGDR2 (0.37) | KDM4EPTGDR2ALDH1A1MEN1KMT2A | |
| SCHEMBL19905816 | 0.84 | KDM4E (0.35) | KDM4EPTGDR2ALDH1A1MEN1KMT2A | |
| SCHEMBL19906247 | 0.84 | ABL1 (0.40) | KDM4EPTGDR2ALDH1A1MEN1KMT2A | |
| SCHEMBL19906277 | 0.83 | PTGDR2 (0.37) | KDM4EPTGDR2ALDH1A1MEN1KMT2A | |
| SCHEMBL19905817 | 0.83 | PTGDR2 (0.38) | KDM4EPTGDR2ALDH1A1MEN1KMT2A | |
| SCHEMBL15342670 | 0.82 | CYP3A4 (0.36) | MAPK14 |
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 |