Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIN1 | Q13526 | 1/20 | 0.31 |
| ▸ | CA12 | O43570 | 2/20 | 0.31 |
| ▸ | CA1 | P00915 | 2/20 | 0.31 |
| ▸ | CA2 | P00918 | 2/20 | 0.31 |
| ▸ | CA7 | P43166 | 2/20 | 0.31 |
| ▸ | CA9 | Q16790 | 2/20 | 0.31 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.31 |
| ▸ | ESR1 | P03372 | 1/20 | 0.31 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 2/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9489691 | 0.83 | — | — | |
| SCHEMBL2543218 | 0.69 | POLB (0.34) | CA12CA1CA2CA7CA9 | |
| SCHEMBL7920956 | 0.68 | POLB (0.33) | CA12CA1CA2CA7CA9 | |
| Propionic Acid SCHEMBL23566717 | 0.63 | FFAR3 (0.36) | KMT2A | |
| SCHEMBL700823 | 0.61 | GRM4 (0.31) | — | |
| SCHEMBL2220182 | 0.60 | — | — | |
| SCHEMBL28078298 | 0.59 | ALDH1A1 (0.39) | PIN1MEN1KMT2AKDM4EMAPT | |
| SCHEMBL7130041 | 0.59 | — | — | |
| Benzene SCHEMBL27623428 | 0.58 | PIN1 (0.46) | PIN1TSHRMEN1KMT2ANPC1 | |
| SCHEMBL4418134 | 0.58 | ALDH1A1 (0.41) | PIN1TSHRMEN1KMT2AKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-0362714-B1 | LIQUID-CRYSTALLINE COMPOUNDS AND LIQUID-CRYSTALLINE POLYMERS | IDEMITSU KOSAN COMPANY LIMITED (JP) | 1993-03-24 | — | — | EP | disclosed |