Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.30 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.30 |
| ▸ | HTR1A | P08908 | 1/20 | 0.30 |
| ▸ | HTR2C | P28335 | 1/20 | 0.30 |
| ▸ | HTR7 | P34969 | 1/20 | 0.30 |
| ▸ | HTR2B | P41595 | 1/20 | 0.30 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL24426978 | 0.74 | CYP3A4 (0.37) | CYP3A4MAPK1ABCB1ALDH1A1KDM4E | |
| SCHEMBL24180230 | 0.66 | CYP3A4 (0.37) | CYP3A4MAPK1ABCB1ALDH1A1KDM4E | |
| SCHEMBL24426966 | 0.66 | — | — | |
| SCHEMBL24180139 | 0.66 | DHPS (0.31) | — | |
| SCHEMBL24180269 | 0.64 | ESR1 (0.33) | CYP3A4ABCB1ALDH1A1ADRB2ADRB1 | |
| SCHEMBL24180227 | 0.63 | CYP3A4 (0.36) | CYP3A4MAPK1ABCB1ALDH1A1KDM4E | |
| SCHEMBL16751353 | 0.62 | HTT (0.40) | CYP3A4MAPK1ABCB1ALDH1A1ADRB2 | |
| SCHEMBL16596095 | 0.61 | RAB9A (0.31) | KDM4EKMT2A | |
| SCHEMBL23889639 | 0.59 | EIF4A1 (0.32) | — | |
| SCHEMBL24180209 | 0.59 | CYP3A4 (0.36) | CYP3A4MAPK1ABCB1ALDH1A1KDM4E |
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-3418273-B1 | FLAVAGLINE DERIVATIVES | PF MEDICAMENT (FR) | 2022-01-12 | — | — | EP | disclosed |