Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR35 | Q9HC97 | 10/20 | 0.47 |
| ▸ | HPGD | P15428 | 4/20 | 0.47 |
| ▸ | CASP1 | P29466 | 3/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.47 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.47 |
| ▸ | USP2 | O75604 | 2/20 | 0.47 |
| ▸ | CASP7 | P55210 | 2/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | CCR6 | P51684 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | MAOA | P21397 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.42 |
| ▸ | GAA | P10253 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL22041620 | 0.82 | GPR35 (0.53) | GPR35HPGDCASP1HSD17B10USP2 | |
| SCHEMBL22041595 | 0.81 | GPR35 (0.47) | GPR35HPGDCASP1HSD17B10ALOX12 | |
| SCHEMBL22041598 | 0.80 | GPR35 (0.55) | GPR35HPGDCASP1HSD17B10ALOX12 | |
| SCHEMBL22041627 | 0.76 | ALDH1A1 (0.58) | GPR35HSD17B10ALDH1A1MAPTMAOA | |
| SCHEMBL22041606 | 0.71 | GPR35 (0.71) | GPR35HPGDCASP1HSD17B10ALOX12 | |
| SCHEMBL22041599 | 0.70 | GPR35 (0.52) | GPR35HPGDCASP1HSD17B10ALOX12 | |
| SCHEMBL18306420 | 0.67 | MAOA (0.71) | GPR35HPGDCASP1HSD17B10ALOX12 | |
| SCHEMBL22041589 | 0.67 | GPR35 (0.50) | GPR35HPGDCASP1HSD17B10ALOX12 | |
| SCHEMBL9068668 | 0.65 | GPR35 (1.00) | GPR35HPGDCASP1HSD17B10ALOX12 | |
| SCHEMBL11536342 | 0.65 | MAOA (0.66) | GPR35HPGDHSD17B10POLBALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020114290-A1 | 3-CARBOXYL COUMARIN DERIVATIVE CAPABLE OF BEING USED AS A GPR35 AGONIST, PREPARATION METHOD, AND APPLICATION | 泰州医药城国科化物生物医药科技有限公司 | 2020-06-11 | — | — | WO | claimed |
| WO-2020114290-A1 | 3-CARBOXYL COUMARIN DERIVATIVE CAPABLE OF BEING USED AS A GPR35 AGONIST, PREPARATION METHOD, AND APPLICATION | 泰州医药城国科化物生物医药科技有限公司 | 2020-06-11 | — | — | WO | disclosed |