Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.38 |
| ▸ | CA2 | P00918 | 2/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA7 | P43166 | 1/20 | 0.38 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.32 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.32 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.32 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.32 |
| ▸ | HTR2A | P28223 | 1/20 | 0.32 |
| ▸ | HTR2C | P28335 | 1/20 | 0.32 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.32 |
| ▸ | HRH1 | P35367 | 1/20 | 0.32 |
| ▸ | DRD3 | P35462 | 1/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.31 |
| ▸ | TSHR | P16473 | 3/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9104581 | 0.83 | CHRM1 (0.40) | CA1CA2CA12CA7CA14 | |
| SCHEMBL4008043 | 0.83 | CHRM1 (0.40) | CA1CA2CA12CA7CA14 | |
| SCHEMBL2437990 | 0.82 | GPR84 (0.38) | CA1CA2CA12CA7CA14 | |
| SCHEMBL7895720 | 0.79 | CA2 (0.40) | CA1CA2CA12CA7CA14 | |
| SCHEMBL26802492 | 0.78 | ALDH1A1 (0.36) | CA1CA2CA12CA7CA14 | |
| SCHEMBL15187256 | 0.77 | MGAM (0.40) | CA1CA2CA12CA7CA14 | |
| SCHEMBL15187280 | 0.77 | MGAM (0.40) | CA1CA2CA12CA7CA14 | |
| SCHEMBL28331224 | 0.77 | LMNA (0.38) | CA1CA2CA12CA7CA14 | |
| SCHEMBL21894626 | 0.75 | CACNA2D1 (0.41) | CA1CA2TDP1CHRM1AKR1A1 | |
| SCHEMBL21881957 | 0.75 | CACNA2D1 (0.41) | CA1CA2TDP1CHRM1AKR1A1 |
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-1998054123-A1 | SUBSTITUTED PEPTIDYLAMINE CALCIUM CHANNEL BLOCKERS | WARNER-LAMBERT COMPANY (US) | 1998-12-03 | — | — | WO | disclosed |