Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.45 |
| ▸ | RXRA | P19793 | 2/20 | 0.41 |
| ▸ | RXRB | P28702 | 1/20 | 0.41 |
| ▸ | RXRG | P48443 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | TRPM8 | Q7Z2W7 | 5/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.38 |
| ▸ | PDE7B | Q9NP56 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.37 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.37 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6808711 | 0.90 | POLB (0.46) | MEN1KMT2AKDM4EPDE7APDE7B | |
| SCHEMBL6493237 | 0.80 | PDE10A (0.54) | PDE10AMAPK1HTTADAM17MEN1 | |
| SCHEMBL6211757 | 0.72 | MEN1 (0.50) | PDE10AMAPK1HTTADAM17MEN1 | |
| SCHEMBL6492382 | 0.71 | AR (0.53) | PDE10AMAPK1ADAM17MEN1KMT2A | |
| SCHEMBL6633311 | 0.69 | GAA (0.53) | RXRARXRBMAPK1HTTMEN1 | |
| SCHEMBL3970688 | 0.68 | PDE10A (0.56) | PDE10AMAPK1HTTMEN1KMT2A | |
| SCHEMBL3970686 | 0.67 | PDE10A (0.54) | PDE10AMAPK1HTTMEN1KMT2A | |
| SCHEMBL27786436 | 0.67 | KMT2A (0.54) | RXRARXRBRXRGKMT2ASMN1; SMN2 | |
| SCHEMBL28173790 | 0.66 | PDE10A (0.51) | PDE10AHTTMEN1KMT2AKDM4E | |
| SCHEMBL6490442 | 0.66 | PDE10A (0.45) | PDE10ARXRAMAPK1TRPM8HTT |
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 |
|---|---|---|---|---|---|---|---|
| US-6962938-B2 | Spiro-cyclic β-amino acid derivatives as inhibitors of matrix metalloproteases and TNF-α converting enzyme (TACE) | BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) | 2005-11-08 | — | — | US | disclosed |