Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FDPS | P14324 | 1/20 | 0.47 |
| ▸ | BRD4 | O60885 | 1/20 | 0.46 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.46 |
| ▸ | DRD2 | P14416 | 1/20 | 0.42 |
| ▸ | DRD4 | P21917 | 1/20 | 0.42 |
| ▸ | DRD3 | P35462 | 1/20 | 0.42 |
| ▸ | CNR2 | P34972 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | ADORA3 | P0DMS8 | 4/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | MAP3K7 | O43318 | 1/20 | 0.38 |
| ▸ | MAP3K6 | O95382 | 1/20 | 0.38 |
| ▸ | MAP3K5 | Q99683 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | CDK2 | P24941 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL13727980 | 0.78 | ADORA3 (0.52) | FDPSBRD4CREBBPDRD2DRD4 | |
| SCHEMBL5874038 | 0.77 | ADORA3 (0.62) | FDPSCNR2ADORA3RAB9ANPC1 | |
| SCHEMBL3800642 | 0.77 | SMN1; SMN2 (0.69) | FDPSSMN1; SMN2ADORA3RAB9AKDM4E | |
| SCHEMBL4879083 | 0.76 | FDPS (0.47) | FDPSBRD4CREBBPDRD2DRD4 | |
| SCHEMBL29825764 | 0.75 | FDPS (0.54) | FDPSBRD4CREBBPDRD2DRD4 | |
| SCHEMBL7599559 | 0.75 | FDPS (0.54) | FDPSBRD4CREBBPDRD2DRD4 | |
| SCHEMBL10051128 | 0.73 | FDPS (0.53) | FDPSBRD4CREBBPDRD2DRD4 | |
| SCHEMBL4411955 | 0.73 | FDPS (0.53) | FDPSBRD4CREBBPDRD2DRD4 | |
| SCHEMBL2361181 | 0.73 | KDM4E (0.56) | FDPSBRD4CREBBPDRD2DRD4 | |
| SCHEMBL7937683 | 0.73 | FDPS (0.49) | FDPSBRD4CREBBPDRD2DRD4 |
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 |
|---|---|---|---|---|---|---|---|
| US-4843077-A | Isoquinoline derivatives having renal vasodilating properties and/or cardiotonic properties and/or phosphodiesterase inhibiting properties | ORTHO PHARMACEUTICAL CORPORATION (US) | 1989-06-27 | — | — | US | disclosed |