Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 6/20 | 0.32 |
| ▸ | LMNA | P02545 | 5/20 | 0.32 |
| ▸ | HTT | P42858 | 4/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.32 |
| ▸ | NR2F2 | P24468 | 2/20 | 0.32 |
| ▸ | NPC1 | O15118 | 3/20 | 0.30 |
| ▸ | S1PR2 | O95136 | 2/20 | 0.30 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.30 |
| ▸ | SLC2A1 | P11166 | 2/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL23937907 | 0.95 | ALOX5 (0.33) | KDM4ERAB9ANPC1KMT2AALDH1A1 | |
| SCHEMBL23937908 | 0.93 | ALOX5 (0.35) | KDM4E | |
| SCHEMBL24701731 | 0.74 | RAB9A (0.36) | KDM4ERAB9ALMNAHTTSMN1; SMN2 | |
| SCHEMBL20631139 | 0.72 | RAB9A (0.36) | KDM4ERAB9ALMNAHTTSMN1; SMN2 | |
| SCHEMBL20631142 | 0.72 | KDM4E (0.33) | KDM4EALDH1A1 | |
| SCHEMBL20631118 | 0.71 | CA2 (0.32) | KDM4ELMNANPSR1CYP1A2CYP2C9 | |
| SCHEMBL20631153 | 0.71 | CNR2 (0.35) | KDM4ELMNAHTTNPC1MEN1 | |
| SCHEMBL14788205 | 0.70 | RAB9A (0.33) | KDM4ERAB9ALMNAHTTSMN1; SMN2 | |
| SCHEMBL20631138 | 0.70 | GRIA2 (0.35) | KDM4ERAB9ANPC1MEN1CYP1A2 | |
| SCHEMBL20631115 | 0.69 | PTGS2 (0.35) | KDM4ECYP1A2CYP2D6ALDH1A1 |
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-3399968-B1 | SELECTIVE INHIBITORS OF CLINICALLY IMPORTANT MUTANTS OF THE EGFR TYROSINE KINASE | CS PHARMATECH LTD (KY) | 2021-10-20 | — | — | EP | disclosed |