Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR7 | P34969 | 6/20 | 0.43 |
| ▸ | HTR1A | P08908 | 2/20 | 0.43 |
| ▸ | USP2 | O75604 | 8/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 7/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 7/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.40 |
| ▸ | TP53 | P04637 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | WHR1 | P49842 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | HPGD | P15428 | 3/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.39 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7582553 | 0.80 | HTR3A (0.54) | HTR7HTR1AMAPK1SMN1; SMN2KDM4E | |
| SCHEMBL7591669 | 0.79 | HTR7 (0.67) | HTR7HTR1AADRB1 | |
| SCHEMBL28792714 | 0.79 | LMNA (0.53) | USP2MAPK1HSD17B10ALDH1A1TP53 | |
| SCHEMBL29699387 | 0.77 | USP2 (0.54) | USP2MAPK1HSD17B10CYP1A2ALDH1A1 | |
| SCHEMBL28792806 | 0.72 | ALDH1A1 (0.60) | USP2MAPK1ALDH1A1TSHRSMN1; SMN2 | |
| SCHEMBL12082315 | 0.70 | ADRB1 (0.53) | USP2HSD17B10ALDH1A1SMN1; SMN2HPGD | |
| SCHEMBL28945391 | 0.67 | ADRB1 (0.56) | HTR7HTR1AMAPK1ALDH1A1TSHR | |
| SCHEMBL20557842 | 0.66 | ADRA2C (0.58) | HTR1AUSP2MAPK1HSD17B10CYP1A2 | |
| SCHEMBL29858370 | 0.66 | ADRA2C (0.58) | HTR1AUSP2MAPK1HSD17B10CYP1A2 | |
| SCHEMBL22643422 | 0.65 | MAPT (0.49) | MAPK1HSD17B10ALDH1A1TSHRSMN1; SMN2 |
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-114773253-A | Preparation method of polysubstituted arylamine compound | 大连理工大学 | 2022-07-22 | — | — | CN | disclosed |