Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 7/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 10/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.57 |
| ▸ | HPGD | P15428 | 2/20 | 0.57 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.55 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.50 |
| ▸ | IL4I1 | Q96RQ9 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | BRD4 | O60885 | 1/20 | 0.46 |
| ▸ | DAO | P14920 | 1/20 | 0.46 |
| ▸ | DDO | Q99489 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL4437503 | 0.82 | MAPK1 (0.58) | TSHRKDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL4428108 | 0.78 | KDM4E (0.60) | TSHRKDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL13349416 | 0.77 | KDM4E (0.59) | TSHRKDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL13316302 | 0.76 | KDM4E (0.66) | TSHRKDM4EALDH1A1HPGDHSD17B10 | |
| Bicarbonate SCHEMBL6993932 | 0.76 | MAPK1 (0.61) | TSHRKDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL5473260 | 0.76 | KDM4E (0.58) | TSHRKDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL31154599 | 0.75 | KDM4E (0.66) | TSHRKDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL1263927 | 0.75 | KDM4E (0.66) | TSHRKDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL7646960 | 0.75 | DAO (0.53) | TSHRKDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL28019884 | 0.75 | TSHR (0.57) | TSHRKDM4EALDH1A1HPGDHSD17B10 |
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-103739599-B | 3-[[2-(2-benzyl hydrazono-) thiazole-5-base] methyl] quinoline-2 (1H)-one and preparation and application thereof | HUNAN UNIVERSITY (CN) | 2015-10-07 | — | — | CN | disclosed |
| CN-103755697-B | 3-[[2-(2-benzyl imino-) thiazole-5-base] methyl] quinoline-2 (1H)-one and preparation and application thereof | HUNAN UNIVERSITY (CN) | 2015-08-05 | — | — | CN | disclosed |