Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 6/20 | 0.34 |
| ▸ | CA1 | P00915 | 6/20 | 0.34 |
| ▸ | CA2 | P00918 | 6/20 | 0.34 |
| ▸ | CA7 | P43166 | 6/20 | 0.34 |
| ▸ | CA9 | Q16790 | 6/20 | 0.34 |
| ▸ | CA14 | Q9ULX7 | 6/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.32 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL11333527 | 0.88 | GABRR1 (0.35) | LMNA | |
| SCHEMBL418069 | 0.76 | CHRM3 (0.45) | ALDH1A1KDM4ELMNAHSD17B10 | |
| SCHEMBL11338912 | 0.75 | TSHR (0.43) | CA12CA1CA2CA7CA9 | |
| SCHEMBL1826545 | 0.73 | — | — | |
| SCHEMBL6884286 | 0.72 | TSHR (0.36) | LMNASMN1; SMN2 | |
| SCHEMBL11333460 | 0.72 | PDK1 (0.42) | ALDH1A1KDM4ELMNAMAPT | |
| SCHEMBL24717156 | 0.71 | P2RX7 (0.40) | — | |
| SCHEMBL24471530 | 0.70 | ALDH1A1 (0.40) | CA12CA1CA2CA7CA9 | |
| SCHEMBL5972221 | 0.70 | CA12 (0.44) | CA12CA1CA2CA7CA9 | |
| SCHEMBL20747451 | 0.70 | MEN1 (0.30) | — |
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-4255588-A | Synthesis of cyclohexene dicarboxylic acid esters | GULF OIL CORPORATION (US) | 1981-03-10 | — | — | US | disclosed |