Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | IDO1 | P14902 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 4/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.35 |
| ▸ | CA1 | P00915 | 3/20 | 0.35 |
| ▸ | CA2 | P00918 | 3/20 | 0.35 |
| ▸ | CA9 | Q16790 | 3/20 | 0.35 |
| ▸ | CA12 | O43570 | 2/20 | 0.35 |
| ▸ | CA3 | P07451 | 2/20 | 0.35 |
| ▸ | CA4 | P22748 | 2/20 | 0.35 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.35 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.35 |
| ▸ | CA7 | P43166 | 2/20 | 0.35 |
| ▸ | GLA | P06280 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 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 | |
|---|---|---|---|---|
| Benzenethiol SCHEMBL7235683 | 1.00 | — | — | |
| Benzenethiol SCHEMBL15809974 | 0.96 | — | — | |
| Benzenethiol SCHEMBL2574156 | 0.96 | ALDH1A1 (0.43) | ALDH1A1IDO1TSHRTDP1CA1 | |
| SCHEMBL22047568 | 0.96 | ALDH1A1 (0.43) | ALDH1A1IDO1TSHRTDP1CA1 | |
| Benzenethiol SCHEMBL67 | 0.96 | — | — | |
| Benzenethiol SCHEMBL28862443 | 0.96 | ALDH1A1 (0.43) | ALDH1A1IDO1TSHRTDP1CA1 | |
| Benzenethiol SCHEMBL490106 | 0.96 | ALDH1A1 (0.43) | ALDH1A1IDO1TSHRTDP1CA1 | |
| Benzenethiol SCHEMBL10796991 | 0.96 | ALDH1A1 (0.43) | ALDH1A1IDO1TSHRTDP1CA1 | |
| Benzenethiol SCHEMBL13834646 | 0.92 | — | — | |
| Benzenethiol SCHEMBL22802141 | 0.92 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113637135-B | Thiourethane polymers, methods of synthesis and use in additive manufacturing techniques | 德州系统大学董事会 | 2022-09-06 | — | — | CN | disclosed |