Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.52 |
| ▸ | MEN1 | O00255 | 4/20 | 0.52 |
| ▸ | POLB | P06746 | 3/20 | 0.52 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 7/20 | 0.49 |
| ▸ | NPC1 | O15118 | 7/20 | 0.49 |
| ▸ | RAB9A | P51151 | 7/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.46 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 4/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.42 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 3/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL28299678 | 0.88 | CYP1A2 (0.49) | CYP1A2CYP2C9CYP2C19KMT2AMEN1 | |
| SCHEMBL28299559 | 0.88 | SMN1; SMN2 (0.52) | CYP1A2CYP2C9CYP2C19KMT2AMEN1 | |
| SCHEMBL28299664 | 0.84 | CYP1A2 (0.54) | CYP1A2CYP2C9CYP2C19KMT2AMEN1 | |
| SCHEMBL8765128 | 0.83 | SMN1; SMN2 (0.67) | CYP1A2CYP2C9CYP2C19KMT2AMEN1 | |
| SCHEMBL28847562 | 0.83 | CYP1A2 (0.47) | CYP1A2CYP2C9CYP2C19KMT2AMEN1 | |
| SCHEMBL31500066 | 0.81 | SMN1; SMN2 (0.59) | CYP1A2CYP2C9CYP2C19KMT2AMEN1 | |
| SCHEMBL31500050 | 0.78 | SMN1; SMN2 (0.56) | CYP1A2CYP2C9CYP2C19KMT2AMEN1 | |
| SCHEMBL31500065 | 0.78 | NPC1 (0.56) | CYP1A2CYP2C9CYP2C19KMT2AMEN1 | |
| SCHEMBL28299741 | 0.78 | RAB9A (0.54) | CYP1A2CYP2C9CYP2C19POLBSMN1; SMN2 | |
| SCHEMBL1574063 | 0.76 | HTR7 (0.57) | CYP1A2CYP2C9CYP2C19KMT2AMEN1 |
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-109890822-A | INHIBITORS OF CELLULAR METABOLIC PROCESSES | 安吉奥斯医药品有限公司 | 2019-06-14 | — | — | CN | disclosed |