Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | NAALAD2 | Q9Y3Q0 | 1/20 | 0.35 |
| ▸ | KDM4A | O75164 | 11/20 | 0.35 |
| ▸ | KDM4C | Q9H3R0 | 11/20 | 0.35 |
| ▸ | PHF8 | Q9UPP1 | 3/20 | 0.35 |
| ▸ | KDM2A | Q9Y2K7 | 3/20 | 0.35 |
| ▸ | KDM7A | Q6ZMT4 | 2/20 | 0.35 |
| ▸ | KDM5A | P29375 | 1/20 | 0.35 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL12265808 | 0.76 | PHF8 (0.40) | MEN1CYP3A4CYP2C9CYP2C19KMT2A | |
| Trifluoroacetic Acid SCHEMBL8653956 | 0.75 | PHF8 (0.31) | MEN1KMT2AKDM4AKDM4CPHF8 | |
| SCHEMBL7747710 | 0.75 | LMNA (0.42) | KMT2AKDM4AKDM4CPHF8KDM2A | |
| SCHEMBL29405740 | 0.74 | LMNA (0.42) | MEN1KMT2APHF8KDM2AKDM7A | |
| Water SCHEMBL7773339 | 0.73 | LMNA (0.40) | KDM4AKDM4CPHF8KDM2AKDM7A | |
| Hydrochloric Acid SCHEMBL8654449 | 0.73 | LMNA (0.40) | KDM4AKDM4CPHF8KDM2AKDM7A | |
| Succinic Acid SCHEMBL10737828 | 0.72 | EGLN1 (0.47) | MEN1CYP3A4KMT2ANAALAD2PHF8 | |
| Succinic Acid SCHEMBL10737815 | 0.72 | EGLN1 (0.47) | MEN1CYP3A4KMT2ANAALAD2PHF8 | |
| SCHEMBL29955022 | 0.71 | — | — | |
| SCHEMBL7398732 | 0.70 | LMNA (0.38) | KMT2AKDM4AKDM4CPHF8KDM2A |
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-1255748-A1 | BETA-ALANINE DERIVATIVES AND THEIR USE AS RECEPTOR ANTAGONISTS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2002-11-13 | — | — | EP | disclosed |
| WO-2001060813-A1 | BETA-ALANINE DERIVATIVES AND THEIR USE AS RECEPTOR ANTAGONISTS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2001-08-23 | — | — | WO | disclosed |