Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGDS | O60760 | 3/20 | 0.56 |
| ▸ | MGAM | O43451 | 1/20 | 0.55 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.54 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.54 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.54 |
| ▸ | BCAT1 | P54687 | 1/20 | 0.51 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.51 |
| ▸ | PPARD | Q03181 | 1/20 | 0.51 |
| ▸ | PREP | P48147 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CFTR | P13569 | 1/20 | 0.48 |
| ▸ | KDR | P35968 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | MITF | O75030 | 1/20 | 0.47 |
| ▸ | XBP1 | P17861 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL13113540 | 0.82 | MGAM (0.56) | HPGDSMGAMHDAC3HDAC1HDAC2 | |
| SCHEMBL7209315 | 0.81 | MGAM (0.59) | HPGDSMGAMHDAC3HDAC1HDAC2 | |
| SCHEMBL20812002 | 0.81 | HPGDS (0.65) | HPGDSMGAMHDAC3HDAC1HDAC2 | |
| SCHEMBL5309154 | 0.80 | MGAM (0.62) | HPGDSMGAMHDAC3HDAC1HDAC2 | |
| SCHEMBL10242977 | 0.80 | HDAC3 (0.61) | HPGDSMGAMHDAC3HDAC1HDAC2 | |
| SCHEMBL6237473 | 0.79 | MGAM (0.65) | HPGDSMGAMHDAC3HDAC1HDAC2 | |
| SCHEMBL22389 | 0.79 | PLK1 (0.65) | HPGDSMGAMHDAC3HDAC1HDAC2 | |
| SCHEMBL24392693 | 0.79 | HPGDS (0.70) | HPGDSMGAMHDAC3HDAC1HDAC2 | |
| SCHEMBL30858823 | 0.79 | HDAC3 (0.61) | HPGDSMGAMHDAC3HDAC1HDAC2 | |
| SCHEMBL29222038 | 0.79 | HDAC3 (0.61) | HPGDSMGAMHDAC3HDAC1HDAC2 |
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 |
|---|---|---|---|---|---|---|---|
| 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 |