Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | SCN9A | Q15858 | 6/20 | 0.41 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | CASP1 | P29466 | 1/20 | 0.37 |
| ▸ | NOS3 | P29474 | 1/20 | 0.36 |
| ▸ | NOS1 | P29475 | 1/20 | 0.36 |
| ▸ | NOS2 | P35228 | 1/20 | 0.36 |
| ▸ | LOX | P28300 | 1/20 | 0.36 |
| ▸ | LOXL3 | P58215 | 1/20 | 0.36 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.36 |
| ▸ | SCN5A | Q14524 | 3/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL16386605 | 0.81 | SCN9A (0.38) | CYP3A4SCN9AKDM4EPOLBMEN1 | |
| SCHEMBL27849454 | 0.81 | NR4A1 (0.41) | SCN9ANR4A1MEN1KMT2ALOX | |
| SCHEMBL8167265 | 0.80 | NR4A1 (0.61) | CYP3A4NR4A1KDM4EPOLBMEN1 | |
| SCHEMBL16655993 | 0.80 | NR4A1 (0.44) | CYP3A4SCN9ANR4A1KDM4EPOLB | |
| SCHEMBL8237311 | 0.80 | TEAD4 (0.44) | SCN9APOLBMEN1MAPTKMT2A | |
| SCHEMBL573928 | 0.80 | MAOA (0.53) | CYP3A4SCN9APOLBMEN1MAPT | |
| SCHEMBL29834775 | 0.77 | NR4A1 (0.41) | SCN9ANR4A1ALDH1A1LOXLOXL3 | |
| SCHEMBL573471 | 0.77 | NR4A1 (0.41) | SCN9ANR4A1ALDH1A1LOXLOXL3 | |
| SCHEMBL16187041 | 0.77 | KDM4E (0.39) | CYP3A4SCN9AKDM4EPOLBMEN1 | |
| SCHEMBL16029077 | 0.76 | LOX (0.40) | SCN9AMEN1KMT2ANOS3NOS1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2864289-B1 | CYCLOPROPANECARBOXAMIDO-SUBSTITUTED AROMATIC COMPOUNDS AS ANTI-TUMOR AGENTS | CB THERAPEUTICS INC (KY) | 2018-04-11 | — | — | EP | disclosed |