Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | CA1 | P00915 | 2/20 | 0.46 |
| ▸ | CA2 | P00918 | 2/20 | 0.46 |
| ▸ | CA12 | O43570 | 1/20 | 0.46 |
| ▸ | CA7 | P43166 | 1/20 | 0.46 |
| ▸ | CA9 | Q16790 | 1/20 | 0.46 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.46 |
| ▸ | AKR1C3 | P42330 | 6/20 | 0.44 |
| ▸ | AKR1C2 | P52895 | 6/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.43 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | APP | P05067 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL31445111 | 1.00 | KMT2A (0.47) | KMT2AKDM4ECA1CA2CA12 | |
| SCHEMBL31446670 | 0.85 | KMT2A (0.46) | KMT2AKDM4ECA1CA2CA12 | |
| SCHEMBL15645990 | 0.84 | CES2 (0.47) | KMT2AKDM4EAKR1C3AKR1C2PTGS2 | |
| SCHEMBL15645912 | 0.84 | CES2 (0.47) | KMT2AKDM4EAKR1C3AKR1C2PTGS2 | |
| SCHEMBL5040787 | 0.82 | CA12 (0.44) | KMT2AKDM4ECA1CA2CA12 | |
| SCHEMBL31446707 | 0.80 | AKR1C3 (0.52) | KMT2AKDM4ECA1CA2CA12 | |
| SCHEMBL20534678 | 0.80 | KDM4E (0.43) | KMT2AKDM4ECA1CA2CA12 | |
| SCHEMBL21632310 | 0.80 | PTGFR (0.45) | KMT2AKDM4ECA1CA2CA12 | |
| SCHEMBL29888943 | 0.79 | NFE2L2 (0.42) | KMT2AKDM4ECA1CA2CA12 | |
| SCHEMBL4302733 | 0.79 | NFE2L2 (0.42) | KMT2AKDM4ECA1CA2CA12 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3609869-A1 | SUBSTITUTED N-ARYLETHYL-2-ARYLQUINOLINE-4-CARBOXAMIDES AND USE THEREOF | Bayer Aktiengesellschaft (DE) | 2020-02-19 | — | — | EP | disclosed |
| WO-2018189011-A1 | SUBSTITUTED N-ARYLETHYL-2-ARYLQUINOLINE-4-CARBOXAMIDES AND USE THEREOF | BAYER AKTIENGESELLSCHAFT (DE) | 2018-10-18 | — | — | WO | disclosed |