Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.41 |
| ▸ | RAB9A | P51151 | 3/20 | 0.41 |
| ▸ | PRSS12 | P56730 | 9/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | OGG1 | O15527 | 1/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL5540977 | 0.74 | DRD4 (0.46) | NPC1RAB9AKMT2A | |
| SCHEMBL5545017 | 0.73 | ALDH1A1 (0.41) | NPC1RAB9APRSS12ALDH1A1LMNA | |
| SCHEMBL5546920 | 0.69 | HTR3E (0.39) | NPC1RAB9AKMT2AMAPTSMN1; SMN2 | |
| SCHEMBL5538116 | 0.67 | SMN1; SMN2 (0.41) | NPC1RAB9AALDH1A1LMNAKMT2A | |
| SCHEMBL5546858 | 0.67 | MEN1 (0.38) | ALDH1A1KMT2ASMN1; SMN2HPGDMAPK1 | |
| SCHEMBL5546197 | 0.66 | NOD2 (0.39) | ALDH1A1LMNAKMT2AMAPTSMN1; SMN2 | |
| SCHEMBL5540282 | 0.64 | MCHR1 (0.42) | NPC1RAB9AALDH1A1LMNAMAPK1 | |
| SCHEMBL5546694 | 0.63 | HTR3A (0.45) | HDAC1 | |
| SCHEMBL14246804 | 0.62 | ALDH1A1 (0.68) | NPC1RAB9AALDH1A1LMNAKMT2A | |
| SCHEMBL5545031 | 0.61 | TP53 (0.38) | NPC1RAB9AALDH1A1LMNAKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| JP-2007534719-A | — | — | 2007-11-29 | — | — | JP | claimed |
| EP-1742925-A1 | SUBSTITUTED 5, 6, 7, 8-TETRAHYDRO-PYRIDO[4, 3-D]PYRIMIDINE-2-YL COMPOUNDS AND 5, 6, 7, 8-TETRAHYDRO-QUINAZOLINE-2-YL COMPOUNDS | Grünenthal GmbH (DE) | 2007-01-17 | — | — | EP | claimed |
| WO-2005105759-A1 | SUBSTITUTED 5, 6, 7, 8-TETRAHYDRO-PYRIDO[4, 3-D]PYRIMIDINE-2-YL COMPOUNDS AND 5, 6, 7, 8-TETRAHYDRO-QUINAZOLINE-2-YL COMPOUNDS | Grünenthal GmbH (DE) | 2005-11-10 | — | — | WO | claimed |