Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IGF1R | P08069 | 1/20 | 0.36 |
| ▸ | ESR1 | P03372 | 1/20 | 0.35 |
| ▸ | EED | O75530 | 1/20 | 0.35 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.34 |
| ▸ | LOXL2 | Q9Y4K0 | 2/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.33 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.33 |
| ▸ | LOX | P28300 | 1/20 | 0.33 |
| ▸ | ELOVL1 | Q9BW60 | 1/20 | 0.33 |
| ▸ | NOS3 | P29474 | 1/20 | 0.32 |
| ▸ | NOS1 | P29475 | 1/20 | 0.32 |
| ▸ | NOS2 | P35228 | 1/20 | 0.32 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL805472 | 0.79 | NOS3 (0.53) | IGF1REEDDYRK1AADORA2AADORA1 | |
| SCHEMBL31627727 | 0.77 | RECQL (0.52) | IGF1REEDDYRK1AADORA2AADORA1 | |
| SCHEMBL12553834 | 0.77 | EED (0.36) | IGF1REEDDYRK1ALOXL2ADORA2A | |
| SCHEMBL12583162 | 0.77 | EED (0.36) | IGF1REEDDYRK1ALOXL2ADORA2A | |
| SCHEMBL1941426 | 0.77 | EED (0.36) | IGF1REEDDYRK1ALOXL2ADORA2A | |
| SCHEMBL4331582 | 0.77 | LOXL2 (0.52) | EEDLOXL2ADORA2AADORA1LOX | |
| SCHEMBL2544342 | 0.77 | RECQL (0.52) | IGF1REEDDYRK1AADORA2AADORA1 | |
| SCHEMBL12747271 | 0.76 | CCR1 (0.43) | ESR1LOXL2LOXNOS3NOS1 | |
| SCHEMBL10223946 | 0.76 | ESR1 (0.40) | ESR1LOXL2LOXNOS3NOS1 | |
| SCHEMBL14706743 | 0.75 | AR (0.42) | ESR1LOXL2LOXNOS3NOS1 |
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 |
|---|---|---|---|---|---|---|---|
| US-9670172-B2 | Heterocyclic compounds and methods of use | MEDIVATION TECHNOLOGIES, INC. (US) | 2017-06-06 | — | — | US | disclosed |