Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | GRM5 | P41594 | 7/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.40 |
| ▸ | KCNK9 | Q9NPC2 | 1/20 | 0.40 |
| ▸ | FPR2 | P25090 | 3/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL15909001 | 1.00 | L3MBTL1 (0.47) | L3MBTL1GRM5CYP2C9CYP2C19CYP2D6 | |
| SCHEMBL15908962 | 1.00 | L3MBTL1 (0.47) | L3MBTL1GRM5CYP2C9CYP2C19CYP2D6 | |
| SCHEMBL37741 | 0.86 | CHRNB2 (0.43) | CYP2C19HPGDRAB9A | |
| SCHEMBL15908968 | 0.86 | CHRNB2 (0.43) | CYP2C19HPGDRAB9A | |
| SCHEMBL37905 | 0.86 | CHRNB2 (0.43) | CYP2C19HPGDRAB9A | |
| SCHEMBL37562 | 0.77 | KMT2A (0.48) | CYP2D6CYP1A2HPGDKMT2AMEN1 | |
| SCHEMBL15908932 | 0.77 | KMT2A (0.48) | CYP2D6CYP1A2HPGDKMT2AMEN1 | |
| SCHEMBL15909047 | 0.77 | KMT2A (0.48) | CYP2D6CYP1A2HPGDKMT2AMEN1 | |
| SCHEMBL15909032 | 0.74 | GRIN2B (0.46) | KMT2AMEN1 | |
| SCHEMBL37525 | 0.74 | GRIN2B (0.46) | KMT2AMEN1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2011149993-A2 | SUBSTITUTED OCTAHYDROCYCLOPENTA[c]PYRROLES AS CALCIUM CHANNEL MODULATORS | ABBOTT LABORATORIES (US) | 2011-12-01 | — | — | WO | claimed |
| WO-2011149993-A2 | SUBSTITUTED OCTAHYDROCYCLOPENTA[c]PYRROLES AS CALCIUM CHANNEL MODULATORS | ABBOTT LABORATORIES (US) | 2011-12-01 | — | — | WO | disclosed |