Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADH1B | P00325 | 5/20 | 1.00 |
| ▸ | ADH1A | P07327 | 5/20 | 1.00 |
| ▸ | ADH1C | P00326 | 4/20 | 1.00 |
| ▸ | ADH4 | P08319 | 2/20 | 1.00 |
| ▸ | ADH7 | P40394 | 3/20 | 0.94 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | EPHX1 | P07099 | 6/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | CA1 | P00915 | 2/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA7 | P43166 | 1/20 | 0.42 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | EPHX2 | P34913 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL2112448 | 1.00 | ADH1B (1.00) | ADH1BADH1AADH1CADH4ADH7 | |
| SCHEMBL9206597 | 1.00 | ADH1B (1.00) | ADH1BADH1AADH1CADH4ADH7 | |
| SCHEMBL645299 | 1.00 | ADH1B (1.00) | ADH1BADH1AADH1CADH4ADH7 | |
| SCHEMBL2109469 | 1.00 | ADH1B (1.00) | ADH1BADH1AADH1CADH4ADH7 | |
| SCHEMBL245391 | 1.00 | ADH1B (1.00) | ADH1BADH1AADH1CADH4ADH7 | |
| SCHEMBL22988657 | 1.00 | ADH1B (1.00) | ADH1BADH1AADH1CADH4ADH7 | |
| Cyclohexylformamide SCHEMBL26146 | 1.00 | — | — | |
| Cyclohexylformamide SCHEMBL817895 | 0.97 | ADH1B (0.94) | ADH1BADH1AADH1CADH4ADH7 | |
| Cyclohexylformamide SCHEMBL816897 | 0.97 | ADH1B (0.94) | ADH1BADH1AADH1CADH4ADH7 | |
| Cyclohexylformamide SCHEMBL815680 | 0.97 | ADH1B (0.94) | ADH1BADH1AADH1CADH4ADH7 |
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-112098529-A | Fecal metabolite for detecting curative effect of active tuberculosis and detection system thereof | 广东省结核病控制中心 | 2020-12-18 | — | — | CN | claimed |
| CN-112098529-A | Fecal metabolite for detecting curative effect of active tuberculosis and detection system thereof | 广东省结核病控制中心 | 2020-12-18 | — | — | CN | disclosed |