Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EDNRA | P25101 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | CASP6 | P55212 | 1/20 | 0.42 |
| ▸ | ESR1 | P03372 | 2/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | BRD4 | O60885 | 1/20 | 0.37 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.36 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.36 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL10037557 | 0.82 | CYP3A4 (0.44) | POLBCYP2C9ALDH1A1ATMBRD4 | |
| SCHEMBL29155508 | 0.79 | POLB (0.43) | EDNRAPOLBCASP6CYP2C9ATM | |
| SCHEMBL6530948 | 0.79 | ALDH1A1 (0.56) | EDNRAALDH1A1KMT2AKDM4E | |
| SCHEMBL10655087 | 0.78 | TSHR (0.56) | POLBALDH1A1KMT2A | |
| SCHEMBL10655079 | 0.78 | TSHR (0.56) | POLBALDH1A1KMT2A | |
| SCHEMBL10655102 | 0.78 | TSHR (0.56) | POLBALDH1A1KMT2A | |
| SCHEMBL18740908 | 0.78 | POLB (0.42) | EDNRAPOLBCASP6CYP2C9ATM | |
| SCHEMBL1892218 | 0.77 | RET (0.51) | POLBCASP6ESR1ESR2ALDH1A1 | |
| SCHEMBL10656603 | 0.75 | ABCB1 (0.39) | EDNRAESR1ESR2CYP2C9 | |
| SCHEMBL10655141 | 0.75 | ABCB1 (0.39) | EDNRAESR1ESR2CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| US-7385064-B1 | Catalysts for use in enantioselective synthesis | THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK | 2008-06-10 | — | — | US | disclosed |