Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 1/20 | 0.44 |
| ▸ | MAT2A | P31153 | 4/20 | 0.39 |
| ▸ | PTGER1 | P34995 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | CTSS | P25774 | 1/20 | 0.36 |
| ▸ | ESR1 | P03372 | 1/20 | 0.35 |
| ▸ | DHODH | Q02127 | 1/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.34 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL22562478 | 0.96 | MAT2A (0.41) | KIF11MAT2APTGER1CYP1A2CYP2C9 | |
| SCHEMBL22562476 | 0.93 | KIF11 (0.39) | KIF11PTGER1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL22562263 | 0.93 | KIF11 (0.40) | KIF11MAT2APTGER1CYP1A2CYP2C9 | |
| SCHEMBL22562244 | 0.92 | KIF11 (0.39) | KIF11MAT2APTGER1CYP1A2CYP2C9 | |
| SCHEMBL22562381 | 0.90 | MEN1 (0.35) | KIF11MEN1KMT2ARAB9ANPC1 | |
| SCHEMBL22562602 | 0.90 | MEN1 (0.37) | KIF11MAT2AMEN1KMT2ARAB9A | |
| SCHEMBL22562353 | 0.90 | RAB9A (0.39) | MAT2APTGER1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL22562369 | 0.88 | ADORA3 (0.37) | KIF11PTGER1MEN1KMT2ARAB9A | |
| SCHEMBL22562245 | 0.87 | PPARG (0.35) | KIF11MEN1KMT2ARAB9ANPC1 | |
| SCHEMBL22562614 | 0.86 | MEN1 (0.40) | CYP1A2CYP2C9MEN1KMT2ARAB9A |
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-3418278-B1 | ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES | CYNORA GMBH (DE) | 2020-10-21 | — | — | EP | disclosed |