Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 6/20 | 0.43 |
| ▸ | HRH1 | P35367 | 6/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.37 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
| ▸ | HTR5A | P47898 | 7/20 | 0.34 |
| ▸ | HTR2C | P28335 | 4/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | DRD2 | P14416 | 1/20 | 0.33 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.33 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.33 |
| ▸ | CHRM3 | P20309 | 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 | |
|---|---|---|---|---|
| SCHEMBL14304542 | 0.83 | HTR2A (0.46) | HTR2AHRH1HDAC3HDAC1HDAC2 | |
| SCHEMBL21887585 | 0.79 | HTR5A (0.40) | HDAC3HDAC1HDAC2HTR5AMEN1 | |
| SCHEMBL14095901 | 0.78 | HDAC3 (0.38) | HDAC3HDAC1HDAC2HTR5AMEN1 | |
| SCHEMBL19114614 | 0.74 | HDAC3 (0.36) | HDAC3HDAC1HDAC2HTR5AKDM4E | |
| SCHEMBL18388633 | 0.74 | HTR5A (0.43) | HDAC3HDAC1HDAC2HTR5AKDM4E | |
| SCHEMBL19308761 | 0.71 | HDAC3 (0.35) | HDAC3HDAC1HDAC2HTR5A | |
| SCHEMBL6881871 | 0.70 | HDAC3 (0.39) | HTR2AHRH1HDAC3HDAC1HDAC2 | |
| SCHEMBL21880653 | 0.70 | HDAC3 (0.36) | HDAC3HDAC1HDAC2HTR5A | |
| SCHEMBL18269674 | 0.70 | HTR5A (0.41) | HTR5AKDM4EMEN1KMT2A | |
| SCHEMBL18324164 | 0.70 | HTR5A (0.41) | HTR5AKDM4EMEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011156811-A2 | COMPOUNDS FOR TREATMENT OF BOVINE MASTITIS | AFFINIUM PHARMACEUTICALS, INC. (CA) | 2011-12-15 | — | — | WO | disclosed |