Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 2/20 | 0.47 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.47 |
| ▸ | PDIA6 | Q15084 | 1/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 2/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 3/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | CASP1 | P29466 | 1/20 | 0.41 |
| ▸ | CASP7 | P55210 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | XDH | P47989 | 1/20 | 0.40 |
| ▸ | CARM1 | Q86X55 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL10282187 | 0.95 | PDIA6 (0.49) | SLC6A2SLC6A4PDIA6SLC6A3TP53 | |
| SCHEMBL5453470 | 0.91 | ALDH1A1 (0.47) | SLC6A2SLC6A4PDIA6SLC6A3TP53 | |
| Hydrochloric Acid SCHEMBL7447137 | 0.89 | ALDH1A1 (0.45) | SLC6A2SLC6A4PDIA6SLC6A3TP53 | |
| SCHEMBL10702177 | 0.89 | PDIA6 (0.56) | SLC6A2SLC6A4PDIA6SLC6A3TP53 | |
| SCHEMBL10870432 | 0.89 | PDIA6 (0.51) | PDIA6NPC1RAB9AMAPTHTT | |
| SCHEMBL10870020 | 0.87 | PDIA6 (0.54) | PDIA6TP53GAANPC1RAB9A | |
| SCHEMBL11650358 | 0.87 | PDIA6 (0.54) | PDIA6TP53GAANPC1RAB9A | |
| SCHEMBL10702555 | 0.87 | ALDH1A1 (0.50) | PDIA6NPC1RAB9AMAPTHTT | |
| SCHEMBL11444520 | 0.85 | SKP2 (0.55) | PDIA6NPC1RAB9AMAPTHTT | |
| SCHEMBL14222962 | 0.84 | TP53 (0.63) | TP53GAAALDH1A1TSHRCARM1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4036824-A | Disazo dyestuffs containing A-O-alkylene-O-SO3 H group | BAYER AKTIENGESELLSCHAFT (DT) | 1977-07-19 | — | — | US | disclosed |
| US-3956267-A | Indole-containing disazo dyestuffs having a sulfatoalkyleneoxy-substituent | BAYER AKTIENGESELLSCHAFT (DT) | 1976-05-11 | — | — | US | disclosed |