Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.39 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.39 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.39 |
| ▸ | MLYCD | O95822 | 4/20 | 0.39 |
| ▸ | CES1 | P23141 | 1/20 | 0.37 |
| ▸ | RXRA | P19793 | 1/20 | 0.36 |
| ▸ | RXRB | P28702 | 1/20 | 0.36 |
| ▸ | NR1H4 | Q96RI1 | 2/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | SRC | P12931 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.33 |
| ▸ | USP5 | P45974 | 1/20 | 0.33 |
| ▸ | ELANE | P08246 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9246353 | 0.89 | CYP2C9 (0.44) | MLYCDRXRARXRBCYP2C9RAB9A | |
| SCHEMBL4425629 | 0.84 | CES1 (0.36) | ESR1ESR2MLYCDCES1NR1H4 | |
| SCHEMBL10712634 | 0.79 | TDP1 (0.52) | CES1RAB9ANPSR1HDAC1HDAC6 | |
| SCHEMBL4197514 | 0.79 | ESR1 (0.43) | ESR1PDCD1ESR2CD274MLYCD | |
| SCHEMBL11299913 | 0.77 | CES1 (0.46) | CES1RAB9A | |
| SCHEMBL6676984 | 0.77 | PPARA (0.49) | CES1CYP2C9RAB9ANPSR1ELANE | |
| SCHEMBL6448136 | 0.77 | ESR1 (0.41) | ESR1PDCD1ESR2CD274MLYCD | |
| SCHEMBL18678827 | 0.77 | TPMT (0.45) | MLYCDCES1RXRARXRBSRC | |
| SCHEMBL20135443 | 0.77 | CA1 (0.55) | RAB9AL3MBTL1TSHR | |
| SCHEMBL3689915 | 0.77 | HPGD (0.52) | CES1RAB9AELANETSHR |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1523506-B1 | NEW DIFUNCTIONAL PHOTOINITIATORS | BASF SE (DE) | 2012-09-12 | — | — | EP | disclosed |
| EP-1523506-B1 | NEW DIFUNCTIONAL PHOTOINITIATORS | BASF SE (DE) | 2012-09-12 | — | — | EP | disclosed |
| US-7723397-B2 | ethylenically unsaturated aminoacrylates; overprinting; for production of scratch-resistant durable surface | CIBA SPECIALTY CHEMICALS CORPORATION (US) | 2010-05-25 | — | — | US | disclosed |
| US-7723397-B2 | ethylenically unsaturated aminoacrylates; overprinting; for production of scratch-resistant durable surface | CIBA SPECIALTY CHEMICALS CORPORATION (US) | 2010-05-25 | — | — | US | disclosed |
| US-7723397-B2 | ethylenically unsaturated aminoacrylates; overprinting; for production of scratch-resistant durable surface | CIBA SPECIALTY CHEMICALS CORPORATION (US) | 2010-05-25 | — | — | US | disclosed |
| US-20050239971-A1 | New difunctional photoinitators | IGM GROUP B.V. (NL) | 2005-10-27 | — | — | US | disclosed |
| EP-1523506-A1 | NEW DIFUNCTIONAL PHOTOINITIATORS | Ciba SC Holding AG (CH) | 2005-04-20 | — | — | EP | disclosed |
| WO-2004009651-A1 | NEW DIFUNCTIONAL PHOTOINITIATORS | CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) | 2004-01-29 | — | — | WO | disclosed |