Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNA7 | P36544 | 1/20 | 0.40 |
| ▸ | LIPE | Q05469 | 1/20 | 0.38 |
| ▸ | SFRP1 | Q8N474 | 1/20 | 0.37 |
| ▸ | CTSS | P25774 | 5/20 | 0.36 |
| ▸ | CTSL | P07711 | 2/20 | 0.36 |
| ▸ | CTSB | P07858 | 2/20 | 0.36 |
| ▸ | CTSK | P43235 | 2/20 | 0.36 |
| ▸ | DRD2 | P14416 | 2/20 | 0.36 |
| ▸ | DRD4 | P21917 | 2/20 | 0.36 |
| ▸ | CCR1 | P32246 | 1/20 | 0.36 |
| ▸ | F2R | P25116 | 1/20 | 0.36 |
| ▸ | MMP2 | P08253 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | MGLL | Q99685 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | CA7 | P43166 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL14815988 | 0.76 | KMT2A (0.46) | CHRNA7LIPESFRP1MMP2KMT2A | |
| SCHEMBL14815632 | 0.66 | EPHX2 (0.47) | CHRNA7LIPEKMT2AMEN1 | |
| SCHEMBL14837219 | 0.65 | CCR1 (0.36) | SFRP1CTSSCCR1KMT2AGAA | |
| SCHEMBL14815622 | 0.64 | TRPV4 (0.52) | CHRNA7KMT2AMEN1GAA | |
| SCHEMBL14815755 | 0.63 | TRPV4 (0.45) | CHRNA7LIPEKMT2AMEN1 | |
| SCHEMBL14815689 | 0.63 | KMT2A (0.46) | KMT2AMEN1GAA | |
| SCHEMBL14815072 | 0.62 | L3MBTL3 (0.55) | CHRNA7LIPEDRD2DRD4KMT2A | |
| SCHEMBL3759328 | 0.62 | KMT2A (0.52) | KMT2AMEN1GAA | |
| SCHEMBL1222165 | 0.61 | ALDH1A1 (0.55) | KMT2AMEN1GAA | |
| SCHEMBL14815335 | 0.61 | MGLL (0.54) | KMT2AMEN1MGLL |
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-2013049174-A1 | SUBSTITUTED OCTAHYDROPYRROLO[1,2-A]PYRAZINE SULFONAMIDES AS CALCIUM CHANNEL BLOCKERS | ABBVIE INC. (US) | 2013-04-04 | — | — | WO | disclosed |