Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | TGFBR1 | P36897 | 11/20 | 0.42 |
| ▸ | MAPK14 | Q16539 | 7/20 | 0.42 |
| ▸ | RAB9A | P51151 | 4/20 | 0.42 |
| ▸ | NPC1 | O15118 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | IDO1 | P14902 | 1/20 | 0.39 |
| ▸ | AR | P10275 | 3/20 | 0.39 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | TGFBR2 | P37173 | 1/20 | 0.38 |
| ▸ | ABL2 | P42684 | 1/20 | 0.38 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL5480864 | 0.80 | CYP1A2 (0.58) | CYP1A2TGFBR1MAPK14RAB9ANPC1 | |
| SCHEMBL7918710 | 0.77 | CYP3A4 (0.53) | CYP1A2RAB9ANPC1KDM4EALDH1A1 | |
| SCHEMBL4541414 | 0.75 | CYP1A2 (0.59) | CYP1A2TGFBR1MAPK14RAB9ANPC1 | |
| SCHEMBL14461196 | 0.73 | CYP1A2 (0.57) | CYP1A2TGFBR1MAPK14RAB9ANPC1 | |
| SCHEMBL7918743 | 0.71 | MAPT (0.56) | CYP1A2TGFBR1MAPK14RAB9ANPC1 | |
| SCHEMBL1227713 | 0.71 | CYP1A2 (0.60) | CYP1A2TGFBR1MAPK14RAB9ANPC1 | |
| SCHEMBL29699887 | 0.71 | CYP1A2 (0.60) | CYP1A2TGFBR1MAPK14RAB9ANPC1 | |
| SCHEMBL27917128 | 0.71 | CYP1A2 (0.60) | CYP1A2TGFBR1MAPK14RAB9ANPC1 | |
| SCHEMBL29610252 | 0.70 | RAB9A (0.49) | CYP1A2TGFBR1RAB9ANPC1KDM4E | |
| SCHEMBL15775443 | 0.70 | RAB9A (0.49) | CYP1A2TGFBR1RAB9ANPC1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| CN-115054608-A | Application of cryptotanshinone substances and combination composition thereof | 澳门大学 | 2022-09-16 | — | — | CN | claimed |