Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.56 |
| ▸ | SRD5A2 | P31213 | 2/20 | 0.53 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.53 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.51 |
| ▸ | USP2 | O75604 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 2/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.48 |
| ▸ | ATM | Q13315 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.48 |
| ▸ | FEN1 | P39748 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 3/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | PGR | P06401 | 1/20 | 0.46 |
| ▸ | XDH | P47989 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL16247158 | 0.93 | TSHR (0.59) | TSHRAKR1C3HDAC8USP2NPC1 | |
| SCHEMBL22210569 | 0.90 | TSHR (0.59) | TSHRAKR1C3HDAC8USP2NPC1 | |
| SCHEMBL8441864 | 0.86 | TSHR (0.69) | TSHRSRD5A2MEN1KMT2APOLB | |
| SCHEMBL28345649 | 0.85 | SRD5A2 (0.68) | TSHRSRD5A2NPC1POLBL3MBTL1 | |
| SCHEMBL521860 | 0.85 | AKR1C3 (0.68) | TSHRAKR1C3HDAC8MEN1KMT2A | |
| Diphenylether SCHEMBL10690245 | 0.84 | TSHR (0.79) | TSHRAKR1C3HDAC8MEN1KMT2A | |
| SCHEMBL710275 | 0.84 | CA12 (0.59) | TSHRAKR1C3HDAC8USP2NPC1 | |
| SCHEMBL2657014 | 0.81 | MCL1 (0.51) | TSHRAKR1C3HDAC8USP2RAB9A | |
| SCHEMBL231253 | 0.81 | LMNA (0.46) | SRD5A2USP2MEN1KMT2ANPC1 | |
| SCHEMBL5733350 | 0.81 | L3MBTL1 (0.69) | TSHRPOLBL3MBTL1ATMTDP1 |
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-108383987-A | Height based on arone structure is at charcoal low-smoke and flame retardant anti-dropping copolyesters and preparation method thereof | 四川大学 | 2018-08-10 | — | — | CN | disclosed |