Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABL1 | P00519 | 1/20 | 0.42 |
| ▸ | BCR | P11274 | 1/20 | 0.42 |
| ▸ | RBP4 | P02753 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | CCR2 | P41597 | 3/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.42 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | GRM5 | P41594 | 1/20 | 0.41 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | MGLL | Q99685 | 1/20 | 0.40 |
| ▸ | GFER | P55789 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL14833209 | 1.00 | ABL1 (0.42) | ABL1BCRRBP4HPGDLMNA | |
| SCHEMBL14815204 | 1.00 | ABL1 (0.42) | ABL1BCRRBP4HPGDLMNA | |
| SCHEMBL14815262 | 1.00 | ABL1 (0.42) | ABL1BCRRBP4HPGDLMNA | |
| SCHEMBL15793881 | 0.95 | LMNA (0.45) | ABL1BCRRBP4HPGDLMNA | |
| SCHEMBL15794025 | 0.95 | LMNA (0.45) | ABL1BCRRBP4HPGDLMNA | |
| SCHEMBL15793953 | 0.95 | LMNA (0.45) | ABL1BCRRBP4HPGDLMNA | |
| SCHEMBL15793984 | 0.95 | LMNA (0.45) | ABL1BCRRBP4HPGDLMNA | |
| SCHEMBL14814622 | 0.91 | MGLL (0.38) | ABL1BCRLMNACCR2KCNH2 | |
| SCHEMBL14815151 | 0.90 | SCN9A (0.43) | HPGDLMNAKCNH2SCN9AKMT2A | |
| SCHEMBL15793732 | 0.89 | LMNA (0.41) | ABL1BCRRBP4HPGDLMNA |
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-2013049164-A1 | SUBSTITUTED OCTAHYDROPYRROLO[1,2-a]PYRAZINES AS CALCIUM CHANNEL BLOCKERS | ABBVIE INC. (US) | 2013-04-04 | — | — | WO | claimed |
| WO-2013049164-A1 | SUBSTITUTED OCTAHYDROPYRROLO[1,2-a]PYRAZINES AS CALCIUM CHANNEL BLOCKERS | ABBVIE INC. (US) | 2013-04-04 | — | — | WO | disclosed |