Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.61 |
| ▸ | CA12 | O43570 | 1/20 | 0.61 |
| ▸ | CA1 | P00915 | 1/20 | 0.61 |
| ▸ | CA2 | P00918 | 1/20 | 0.61 |
| ▸ | GLA | P06280 | 1/20 | 0.61 |
| ▸ | CA3 | P07451 | 1/20 | 0.61 |
| ▸ | CA4 | P22748 | 1/20 | 0.61 |
| ▸ | CA9 | Q16790 | 1/20 | 0.61 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.61 |
| ▸ | CES2 | O00748 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 4/20 | 0.48 |
| ▸ | TSHR | P16473 | 3/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
| ▸ | PARP1 | P09874 | 2/20 | 0.48 |
| ▸ | BLM | P54132 | 2/20 | 0.48 |
| ▸ | PMP22 | Q01453 | 2/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | RECQL | P46063 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| Phenol SCHEMBL5934375 | 1.00 | TDP1 (0.61) | TDP1CA12CA1CA2GLA | |
| Phenol SCHEMBL28139624 | 0.91 | CA2 (0.50) | TDP1CA12CA1CA2GLA | |
| Phenol SCHEMBL2378225 | 0.88 | CA12 (0.69) | TDP1CA12CA1CA2GLA | |
| Phenol SCHEMBL4258503 | 0.88 | CA2 (0.69) | TDP1CA12CA1CA2GLA | |
| Phenol SCHEMBL11206985 | 0.88 | CA12 (0.69) | TDP1CA12CA1CA2GLA | |
| Phenol SCHEMBL1448002 | 0.88 | CA2 (0.69) | TDP1CA12CA1CA2GLA | |
| Phenol SCHEMBL726343 | 0.88 | CA12 (0.69) | TDP1CA12CA1CA2GLA | |
| Phenol SCHEMBL10886697 | 0.88 | CA12 (0.69) | TDP1CA12CA1CA2GLA | |
| Phenol SCHEMBL21799205 | 0.88 | CA12 (0.69) | TDP1CA12CA1CA2GLA | |
| Phenol SCHEMBL166786 | 0.88 | CA2 (0.69) | TDP1CA12CA1CA2GLA |
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-103384672-B | The substituted piperazine of N-pteridine and piperazine pteridinone | 武田药品工业株式会社 | 2016-09-28 | — | — | CN | disclosed |