Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 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 | |
|---|---|---|---|---|
| SCHEMBL12308654 | 0.86 | HDAC1 (0.40) | HDAC1 | |
| SCHEMBL14417111 | 0.82 | CYP2D6 (0.39) | KDM4EKMT2ACYP2D6SLC6A2SLC6A4 | |
| SCHEMBL13278351 | 0.82 | CYP2D6 (0.39) | KDM4EKMT2ACYP2D6SLC6A2SLC6A4 | |
| SCHEMBL1768108 | 0.82 | HDAC1 (0.38) | HDAC1 | |
| SCHEMBL11381051 | 0.80 | CYP2C19 (0.38) | HDAC1CYP1A2 | |
| SCHEMBL9524739 | 0.78 | CYP2C19 (0.36) | HDAC1CYP1A2 | |
| SCHEMBL29090668 | 0.78 | KDM4E (0.48) | KDM4EKMT2A | |
| SCHEMBL19111018 | 0.77 | HDAC1 (0.35) | KDM4EHDAC1 | |
| Hydrochloric Acid SCHEMBL38659460 | 0.76 | KDM4E (0.47) | KDM4EKMT2A | |
| SCHEMBL378748 | 0.75 | OPRM1 (0.47) | KDM4EKMT2ACYP2D6SLC6A2SLC6A4 |
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-2008045564-A2 | CARBOXAMIDE COMPOUNDS AND THEIR USE AS ANTAGONISTS OF THE CHEMOKINE CCR2 RECEPTOR | EPIX DELAWARE, INC. (US) | 2008-04-17 | — | — | WO | disclosed |