Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 6/20 | 0.41 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | CD44 | P16070 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | CASP3 | P42574 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.34 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.34 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.34 |
| ▸ | ESR1 | P03372 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | CDC25B | P30305 | 2/20 | 0.33 |
| ▸ | MMP2 | P08253 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 4/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL24385024 | 0.82 | ALDH1A1 (0.48) | CYP3A4TSHRALDH1A1HSD17B10MAOA | |
| SCHEMBL22030308 | 0.80 | MAOA (0.42) | CYP3A4TSHRALDH1A1HSD17B10MAOA | |
| SCHEMBL6405519 | 0.78 | CYP3A4 (0.54) | CYP3A4TSHRPIK3CAALDH1A1HSD17B10 | |
| SCHEMBL13464292 | 0.78 | CYP3A4 (0.54) | CYP3A4TSHRPIK3CAALDH1A1HSD17B10 | |
| SCHEMBL11409639 | 0.77 | ALDH1A1 (0.49) | CYP3A4TSHRPIK3CAALDH1A1HSD17B10 | |
| SCHEMBL24832773 | 0.77 | ESR1 (0.41) | ALDH1A1MAOAMAOBKDM4ENPC1 | |
| SCHEMBL7102004 | 0.74 | MAOA (0.41) | CYP3A4TSHRALDH1A1HSD17B10MAOA | |
| SCHEMBL15694585 | 0.73 | CYP3A4 (0.48) | CYP3A4TSHRPIK3CAALDH1A1HSD17B10 | |
| SCHEMBL27683399 | 0.72 | TSHR (0.46) | CYP3A4TSHRPIK3CAALDH1A1HSD17B10 | |
| SCHEMBL10354212 | 0.72 | TSHR (0.42) | CYP3A4TSHRALDH1A1HSD17B10KDM4E |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3204360-B1 | THERAPEUTIC COMPOUNDS AND USES THEREOF | GENENTECH INC (US) | 2020-08-26 | — | — | EP | disclosed |
| EP-3283459-B1 | MOLECULES HAVING PESTICIDAL UTILITY, AND INTERMEDIATES, COMPOSITIONS, AND PROCESSES, RELATED THERETO | DOW AGROSCIENCES LLC (US) | 2019-05-22 | — | — | EP | disclosed |