Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LOX | P28300 | 1/20 | 0.39 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | IKBKB | O14920 | 1/20 | 0.36 |
| ▸ | TUBB1 | Q9H4B7 | 1/20 | 0.36 |
| ▸ | HTR7 | P34969 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
| ▸ | DHPS | P49366 | 2/20 | 0.32 |
| ▸ | HTR1A | P08908 | 1/20 | 0.32 |
| ▸ | BRD4 | O60885 | 1/20 | 0.32 |
| ▸ | RECQL | P46063 | 1/20 | 0.31 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL11705762 | 0.91 | IKBKB (0.37) | LOXAOC3ALDH1A1TP53CYP3A4 | |
| SCHEMBL25236092 | 0.78 | POLB (0.42) | LOXAOC3ALDH1A1TP53TSHR | |
| SCHEMBL30464802 | 0.78 | POLB (0.42) | LOXAOC3ALDH1A1TP53TSHR | |
| SCHEMBL4815160 | 0.78 | TP53 (0.44) | LOXAOC3ALDH1A1TP53TUBB1 | |
| SCHEMBL13324328 | 0.78 | LOX (0.42) | LOXAOC3ALDH1A1TSHRTDP1 | |
| SCHEMBL455549 | 0.76 | ALDH1A1 (0.41) | LOXAOC3ALDH1A1TP53CYP3A4 | |
| SCHEMBL29353325 | 0.76 | ALDH1A1 (0.41) | LOXAOC3ALDH1A1TP53CYP3A4 | |
| SCHEMBL11706798 | 0.76 | TSHR (0.43) | LOXAOC3ALDH1A1TP53CYP3A4 | |
| SCHEMBL11706025 | 0.75 | TP53 (0.46) | ALDH1A1TP53CYP3A4TSHRTDP1 | |
| Hydrochloric Acid SCHEMBL10361244 | 0.74 | ALDH1A1 (0.40) | LOXAOC3ALDH1A1TP53CYP3A4 |
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 |