Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.61 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 2/20 | 0.46 |
| ▸ | ABL1 | P00519 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | THRB | P10828 | 1/20 | 0.43 |
| ▸ | APEX1 | P27695 | 1/20 | 0.43 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.43 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| Hydrogen Sulfide SCHEMBL28084099 | 0.98 | ALDH1A1 (0.59) | ALDH1A1LMNAHSD17B10TSHRKMT2A | |
| SCHEMBL4231627 | 0.81 | ALDH1A1 (0.54) | ALDH1A1LMNAKMT2AMEN1SMN1; SMN2 | |
| SCHEMBL11336870 | 0.80 | ALDH1A1 (0.61) | ALDH1A1LMNAHSD17B10TSHRKMT2A | |
| SCHEMBL31201618 | 0.78 | ALDH1A1 (0.63) | ALDH1A1LMNAHSD17B10TSHRKMT2A | |
| SCHEMBL2211930 | 0.76 | ALDH1A1 (0.61) | ALDH1A1LMNAHSD17B10TSHRKMT2A | |
| SCHEMBL2644442 | 0.76 | ALDH1A1 (1.00) | ALDH1A1LMNAHSD17B10TSHRKMT2A | |
| SCHEMBL12993518 | 0.76 | HDAC6 (0.63) | ALDH1A1LMNAHSD17B10TSHRKMT2A | |
| Hydrogen Sulfide SCHEMBL28084028 | 0.74 | ALDH1A1 (0.96) | ALDH1A1LMNAHSD17B10TSHRKMT2A | |
| SCHEMBL967720 | 0.73 | TSHR (0.46) | ALDH1A1LMNATSHRKMT2AMEN1 | |
| SCHEMBL12787954 | 0.72 | RAB9A (0.52) | ALDH1A1HSD17B10TSHRKMT2AMEN1 |
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-103772377-B | 1,3, 4-thiadiazole benzisothiazolinone acetamide derivative and synthetic method thereof | NANJING TECH UNIVERSITY (CN) | 2016-04-13 | — | — | CN | disclosed |