Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | PGR | P06401 | 8/20 | 0.49 |
| ▸ | AR | P10275 | 5/20 | 0.41 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.40 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.40 |
| ▸ | HTR2C | P28335 | 5/20 | 0.40 |
| ▸ | HTR2A | P28223 | 4/20 | 0.40 |
| ▸ | HTR2B | P41595 | 4/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.37 |
| ▸ | HTR1A | P08908 | 1/20 | 0.37 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL10840856 | 0.87 | ALDH1A1 (0.61) | ALDH1A1HTTPGRARNR3C1 | |
| SCHEMBL6141613 | 0.81 | ALDH1A1 (0.51) | ALDH1A1HTTPGRARNR3C1 | |
| SCHEMBL29837461 | 0.81 | ALDH1A1 (0.51) | ALDH1A1HTTPGRARNR3C1 | |
| SCHEMBL6653007 | 0.80 | ALDH1A1 (0.50) | ALDH1A1HTTPGRARNR3C1 | |
| SCHEMBL1934505 | 0.80 | ALDH1A1 (0.50) | ALDH1A1HTTPGRARNR3C1 | |
| SCHEMBL8518452 | 0.80 | ALDH1A1 (0.50) | ALDH1A1HTTPGRARNR3C1 | |
| SCHEMBL30973127 | 0.80 | ALDH1A1 (0.60) | ALDH1A1HTTPGRARNR3C1 | |
| SCHEMBL31476366 | 0.79 | ALDH1A1 (0.49) | ALDH1A1HTTPGRARNR3C1 | |
| SCHEMBL31476408 | 0.78 | ALDH1A1 (0.48) | ALDH1A1HTTPGRARNR3C1 | |
| SCHEMBL8604696 | 0.78 | ALDH1A1 (0.48) | ALDH1A1HTTPGRARNR3C1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4185151-A | 1-R-2-(U-HYDROXYALKYL-2,2,4-TRIMETHYL TETRAHYDROQUINOL-6-YL) BENZ(CD)INDOLES | BAYER AKTIENGESELLSCHAFT (DE) | 1980-01-22 | — | — | US | disclosed |
| US-4000141-A | SUBSTITUTED TETRAHYDRO QUINOLINE CATIONIC DYESTUFFS | BAYER AKTIENGESELLSCHAFT (DT) | 1976-12-28 | — | — | US | disclosed |
| US-3991042-A | Basic azo dyestuffs containing a benzthiazole and a tetrahydroquinoline nucleus | BAYER AKTIENGESELLSCHAFT (DT) | 1976-11-09 | — | — | US | disclosed |