Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.58 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.53 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.53 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.53 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | HPGD | P15428 | 2/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 3/20 | 0.51 |
| ▸ | TP53 | P04637 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.49 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.49 |
| ▸ | NAMPT | P43490 | 1/20 | 0.48 |
| ▸ | PPARG | P37231 | 1/20 | 0.48 |
| ▸ | BRD4 | O60885 | 1/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.47 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL8816842 | 0.85 | KMT2A (0.52) | KMT2ACHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL7517695 | 0.84 | NPC1 (0.55) | KMT2ACHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL8816782 | 0.83 | CHRNB2 (0.54) | KMT2ACHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL29050680 | 0.81 | RAB9A (0.64) | KMT2AKDM4EALDH1A1HPGDMAPT | |
| SCHEMBL7609032 | 0.80 | CHRNB2 (0.60) | KMT2ACHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL7515855 | 0.79 | KMT2A (0.50) | KMT2AKDM4EALDH1A1HPGDLMNA | |
| SCHEMBL8817925 | 0.79 | KMT2A (0.45) | KMT2ACHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL7743977 | 0.77 | KMT2A (0.44) | KMT2ACHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL7407228 | 0.77 | NPC1 (0.60) | KMT2ACHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL9369344 | 0.75 | CHRNB2 (0.58) | CHRNB2CHRNB4CHRNA3CHRNA4KDM4E |
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-0757670-B1 | BENZAMIDE DERIVATIVES AS VASOPRESSIN ANTAGONISTS | FUJISAWA PHARMACEUTICAL CO (JP) | 1999-01-13 | — | — | EP | disclosed |