Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TPMT | P51580 | 5/20 | 0.58 |
| ▸ | HCAR1 | Q9BXC0 | 1/20 | 0.46 |
| ▸ | CA12 | O43570 | 3/20 | 0.44 |
| ▸ | CA1 | P00915 | 3/20 | 0.44 |
| ▸ | CA2 | P00918 | 3/20 | 0.44 |
| ▸ | CA7 | P43166 | 3/20 | 0.44 |
| ▸ | CA9 | Q16790 | 3/20 | 0.44 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.44 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.43 |
| ▸ | TTR | P02766 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | MYC | P01106 | 1/20 | 0.42 |
| ▸ | ESR1 | P03372 | 1/20 | 0.42 |
| ▸ | PTPN7 | P35236 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | CA3 | P07451 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL23817375 | 0.89 | TPMT (0.71) | TPMTHCAR1CA12CA1CA2 | |
| SCHEMBL27910659 | 0.87 | TPMT (0.50) | TPMTHCAR1CA12CA1CA2 | |
| SCHEMBL29264357 | 0.85 | TPMT (0.48) | TPMTHCAR1CA12CA1CA2 | |
| SCHEMBL16769478 | 0.80 | CA5A (0.48) | TPMTSMN1; SMN2TDP1CA5ALMNA | |
| SCHEMBL25604523 | 0.79 | TPMT (0.58) | TPMTHCAR1CA12CA1CA2 | |
| SCHEMBL8047467 | 0.79 | TPMT (0.59) | TPMTHCAR1CA12CA1CA2 | |
| SCHEMBL1572119 | 0.79 | TPMT (0.59) | TPMTHCAR1CA12CA1CA2 | |
| SCHEMBL18582759 | 0.79 | TTR (0.51) | TPMTTTRALDH1A1 | |
| SCHEMBL16384672 | 0.78 | TPMT (0.34) | TPMTTSHRALDH1A1SMN1; SMN2TDP1 | |
| SCHEMBL2869068 | 0.78 | PARP1 (0.43) | CA1CA2HSD17B10TSHRSMN1; SMN2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111377832-A | Novel method for preparing irudoline intermediate | 江苏联昇化学有限公司 | 2020-07-07 | — | — | CN | claimed |
| CN-111377832-A | Novel method for preparing irudoline intermediate | 江苏联昇化学有限公司 | 2020-07-07 | — | — | CN | disclosed |
| CN-111377832-A | Novel method for preparing irudoline intermediate | 江苏联昇化学有限公司 | 2020-07-07 | — | — | CN | disclosed |
| EP-2821410-A2 | Ancillary ligands for organometallic complexes | Universal Display Corporation (US) | 2015-01-07 | — | — | EP | disclosed |