Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | ADRB2 | P07550 | 3/20 | 0.42 |
| ▸ | ADRB1 | P08588 | 3/20 | 0.42 |
| ▸ | ADRB3 | P13945 | 3/20 | 0.42 |
| ▸ | PPARG | P37231 | 2/20 | 0.42 |
| ▸ | PPARA | Q07869 | 2/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 1/20 | 0.40 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | CPA1 | P15085 | 1/20 | 0.39 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.39 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL11947646 | 0.83 | DPP4 (0.44) | CYP1A2SMN1; SMN2PPARGPPARACYP2D6 | |
| SCHEMBL16476537 | 0.83 | CYP1A2 (0.56) | CYP1A2SMN1; SMN2KDM4ELMNAADRB2 | |
| SCHEMBL375857 | 0.83 | CYP1A2 (0.56) | CYP1A2SMN1; SMN2KDM4ELMNAADRB2 | |
| Hydrochloric Acid SCHEMBL7460562 | 0.82 | DPP4 (0.43) | CYP1A2SMN1; SMN2PPARGPPARACYP2D6 | |
| SCHEMBL28148987 | 0.78 | PPARG (0.40) | LMNAPPARGPPARACPA1TRPA1 | |
| SCHEMBL28888804 | 0.76 | CYP1A2 (0.47) | CYP1A2SMN1; SMN2KDM4ELMNACYP2D6 | |
| SCHEMBL5762294 | 0.74 | MAOB (0.54) | SMN1; SMN2KDM4ELMNAMAOBPARP10 | |
| SCHEMBL1907744 | 0.73 | EPHX1 (0.45) | PPARGPPARAMAOBPARP10CPA1 | |
| SCHEMBL14861285 | 0.72 | CYP1A2 (0.47) | CYP1A2SMN1; SMN2KDM4ELMNACYP2D6 | |
| SCHEMBL16434845 | 0.72 | LOXL2 (0.50) | CYP1A2PPARGPPARACYP2D6MAOB |
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-103958515-B | Amino-substituted imidazopyridazines | 拜耳知识产权有限责任公司 | 2016-11-09 | — | — | CN | disclosed |