Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PRCP | P42785 | 7/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | CAMK2A | Q9UQM7 | 1/20 | 0.41 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 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 | |
|---|---|---|---|---|
| SCHEMBL358171 | 0.88 | PRCP (0.58) | PRCPTSHRNPSR1GAAMAPT | |
| SCHEMBL30924714 | 0.88 | PRCP (0.58) | PRCPTSHRNPSR1GAAMAPT | |
| SCHEMBL13091446 | 0.77 | PRCP (0.49) | PRCPTSHRNPSR1GAASLC22A1 | |
| Hydrochloric Acid SCHEMBL28262412 | 0.76 | GAA (0.47) | PRCPTSHRNPSR1GAACYP2D6 | |
| SCHEMBL359803 | 0.75 | CHRNB2 (0.44) | TSHRMAPTCYP1A2CYP2D6CYP2C9 | |
| SCHEMBL29568322 | 0.75 | CHRNB2 (0.44) | TSHRMAPTCYP1A2CYP2D6CYP2C9 | |
| SCHEMBL14395237 | 0.75 | CHRNB2 (0.44) | TSHRMAPTCYP1A2CYP2D6CYP2C9 | |
| SCHEMBL21847059 | 0.74 | CYP1A2 (0.62) | TSHRCYP1A2CYP2D6CYP2C9CYP2C19 | |
| Bromide SCHEMBL3966126 | 0.74 | CHRNB2 (0.42) | TSHRMAPTCYP1A2CYP2D6CYP2C9 | |
| Hydrochloric Acid SCHEMBL27585427 | 0.74 | MAPT (0.44) | TSHRNPSR1GAAMAPTCYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-111278840-A | Pyrrolo [2, 3-B ] pyridine compounds and their use for treating cancer | 癌症研究科技有限公司 | 2020-06-12 | — | — | CN | disclosed |
| CN-110997068-A | Radiolabeled fluorescent PARP inhibitors for imaging and radiotherapy | 宾夕法尼亚大学董事会 | 2020-04-10 | — | — | CN | disclosed |