Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CPS1 | P31327 | 2/20 | 0.54 |
| ▸ | HPGD | P15428 | 8/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | CNR1 | P21554 | 3/20 | 0.51 |
| ▸ | USP2 | O75604 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 3/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL29606862 | 1.00 | CPS1 (0.54) | CPS1HPGDALDH1A1CNR1USP2 | |
| SCHEMBL28351918 | 0.82 | CPS1 (0.59) | CPS1HPGDALDH1A1TSHRMEN1 | |
| SCHEMBL29816274 | 0.82 | CNR1 (0.63) | CPS1HPGDALDH1A1CNR1USP2 | |
| Hydrochloric Acid SCHEMBL28469010 | 0.81 | CNR1 (0.61) | CPS1HPGDALDH1A1CNR1USP2 | |
| SCHEMBL5096987 | 0.81 | HPGD (0.55) | HPGDALDH1A1TSHRPOLBKMT2A | |
| SCHEMBL1355120 | 0.80 | HPGD (0.56) | CPS1HPGDALDH1A1TSHRPOLB | |
| SCHEMBL12205464 | 0.79 | CPS1 (0.58) | CPS1HPGDALDH1A1CNR1USP2 | |
| SCHEMBL5110700 | 0.79 | POLB (0.66) | HPGDALDH1A1USP2TSHRPOLB | |
| SCHEMBL5103701 | 0.79 | L3MBTL3 (0.62) | HPGDALDH1A1TSHRPOLBMEN1 | |
| SCHEMBL969401 | 0.79 | CCKBR (0.58) | CPS1HPGDALDH1A1CNR1USP2 |
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-110759889-B | 2-aryl amido substituted thiophene imide ester compound and preparation method and application thereof | 中国医学科学院药物研究所 | 2022-05-20 | — | — | CN | disclosed |
| CN-110759889-A | 2-aryl amido substituted thiophene imide ester compound and preparation method and application thereof | 中国医学科学院药物研究所 | 2020-02-07 | — | — | CN | disclosed |