Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADH1B | P00325 | 1/20 | 0.40 |
| ▸ | ADH1C | P00326 | 1/20 | 0.40 |
| ▸ | ADH1A | P07327 | 1/20 | 0.40 |
| ▸ | PYGL | P06737 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL22951198 | 0.78 | PYGL (0.39) | PYGLCA12CA1CA2CA9 | |
| SCHEMBL3402500 | 0.78 | PYGL (0.39) | PYGLCA12CA1CA2CA9 | |
| SCHEMBL22305724 | 0.76 | PYGL (0.38) | PYGLCA12CA1CA2CA9 | |
| SCHEMBL22114486 | 0.76 | ADH1B (0.38) | ADH1BADH1CADH1ALMNA | |
| SCHEMBL3075746 | 0.74 | — | — | |
| SCHEMBL19751307 | 0.74 | MVD (0.38) | LMNA | |
| SCHEMBL24738913 | 0.73 | LMNA (0.30) | LMNA | |
| SCHEMBL8623620 | 0.72 | CA1 (0.41) | PYGLCA12CA1CA2CA9 | |
| SCHEMBL17689169 | 0.70 | PYGL (0.40) | PYGLCA12CA1CA2CA9 | |
| SCHEMBL12734485 | 0.70 | ALDH1A1 (0.42) | PYGLCA12CA1CA2CA9 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8394789-B2 | (Dihydro)pyrrolo[2,1-α]isoquinolines | MSD OSS B.V. (NL) | 2013-03-12 | — | — | US | disclosed |
| EP-2252611-A1 | (DIHYDRO)PYRROLO[2,1-A]ISOQUINOLINES | N.V. Organon (NL) | 2010-11-24 | — | — | EP | disclosed |
| WO-2009098283-A1 | (DIHYDRO)PYRROLO[2,1-A]ISOQUINOLINES | N.V. ORGANON (NL) | 2009-08-13 | — | — | WO | disclosed |