Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 5/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | HTR1A | P08908 | 4/20 | 0.41 |
| ▸ | HTR2C | P28335 | 3/20 | 0.40 |
| ▸ | HTR2B | P41595 | 2/20 | 0.40 |
| ▸ | HTR1D | P28221 | 2/20 | 0.40 |
| ▸ | HTR1B | P28222 | 2/20 | 0.40 |
| ▸ | HTR7 | P34969 | 2/20 | 0.40 |
| ▸ | HTR6 | P50406 | 2/20 | 0.40 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.40 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.40 |
| ▸ | HTR1E | P28566 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 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 | |
|---|---|---|---|---|
| SCHEMBL28358874 | 0.80 | HTR2A (0.48) | HTR2AMEN1KMT2ANPC1GAA | |
| SCHEMBL22555840 | 0.80 | CDK4 (0.47) | HTR2AMEN1KMT2ANPC1GAA | |
| SCHEMBL28358982 | 0.76 | CDK4 (0.42) | HTR2AMEN1KMT2ANPC1GAA | |
| SCHEMBL28358885 | 0.74 | CDK4 (0.43) | HTR2AMEN1KMT2ANPC1GAA | |
| SCHEMBL28358898 | 0.74 | CDK4 (0.41) | HTR2AMEN1KMT2ANPC1GAA | |
| SCHEMBL28355005 | 0.72 | CDK4 (0.41) | HTR2AMEN1KMT2ANPC1GAA | |
| SCHEMBL28359180 | 0.72 | HTR1A (0.41) | HTR2ARAB9AHTR1ASLC6A2SLC6A4 | |
| SCHEMBL28355198 | 0.70 | CDK4 (0.44) | HTR2AMEN1KMT2ANPC1GAA | |
| SCHEMBL28355103 | 0.70 | ALDH1A1 (0.48) | HTR2AMEN1KMT2ANPC1GAA | |
| SCHEMBL734207 | 0.70 | HTR2A (0.52) | HTR2AMEN1KMT2ANPC1GAA |
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-110831600-B | Indole AHR inhibitors and uses thereof | 医肯纳肿瘤学公司 | 2023-10-17 | — | — | CN | disclosed |