Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | CES2 | O00748 | 3/20 | 0.36 |
| ▸ | CES1 | P23141 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | P2RY4 | P51582 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | BRD4 | O60885 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | AGBL2 | Q5U5Z8 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL12466726 | 0.84 | KDM4E (0.46) | KDM4EKEAP1TSHRCES2CES1 | |
| SCHEMBL15636696 | 0.84 | KDM4E (0.66) | KDM4EKEAP1CES2CES1P2RY4 | |
| SCHEMBL20670577 | 0.82 | CES2 (0.47) | SMN1; SMN2KEAP1TSHRCES2CES1 | |
| SCHEMBL29664155 | 0.82 | CES2 (0.47) | SMN1; SMN2KEAP1TSHRCES2CES1 | |
| SCHEMBL21603339 | 0.80 | KDM4E (0.37) | KDM4ETSHRALDH1A1TP53CYP3A4 | |
| SCHEMBL1060105 | 0.79 | KDM4E (0.47) | KDM4ESMN1; SMN2TSHRALDH1A1HPGD | |
| SCHEMBL27303784 | 0.79 | SMN1; SMN2 (0.40) | KDM4ESMN1; SMN2TSHRCES2CES1 | |
| SCHEMBL2771019 | 0.79 | KDM4E (0.70) | KDM4ESMN1; SMN2TSHRALDH1A1TP53 | |
| SCHEMBL10595723 | 0.78 | GSK3B (0.36) | SMN1; SMN2KEAP1CES2CES1ALDH1A1 | |
| SCHEMBL2719368 | 0.78 | KEAP1 (0.36) | KDM4EKEAP1CES2CES1ALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114206870-B | Tricyclic AKR1C 3-dependent KARS inhibitors | 诺华股份有限公司 | 2024-09-03 | — | — | CN | disclosed |
| CN-114206870-A | Tricyclic AKR1C3 dependent KARS inhibitors | 诺华股份有限公司 | 2022-03-18 | — | — | CN | disclosed |