Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | GPR142 | Q7Z601 | 4/20 | 0.47 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 5/20 | 0.47 |
| ▸ | LMNA | P02545 | 4/20 | 0.47 |
| ▸ | HTT | P42858 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.42 |
| ▸ | TP53 | P04637 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | CCR2 | P41597 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL3078123 | 0.85 | MEN1 (0.50) | MEN1KMT2ANPC1RAB9AGPR142 | |
| SCHEMBL3084329 | 0.79 | HSP90AA1 (0.61) | MEN1KMT2ANPC1RAB9AGPR142 | |
| SCHEMBL15062704 | 0.75 | LMNA (0.50) | NPC1RAB9ALMNAHTTALDH1A1 | |
| SCHEMBL25574440 | 0.75 | GPR142 (0.57) | MEN1KMT2ANPC1RAB9AGPR142 | |
| SCHEMBL25205398 | 0.73 | MEN1 (0.56) | MEN1KMT2ANPC1RAB9AGPR142 | |
| SCHEMBL3088692 | 0.72 | GPR142 (0.47) | GPR142TRPV1MAPTALDH1A1HPGD | |
| SCHEMBL5539180 | 0.71 | HPGD (0.52) | NPC1RAB9AHPGDSMN1; SMN2L3MBTL1 | |
| Hydrochloric Acid SCHEMBL3092406 | 0.71 | GPR142 (0.47) | GPR142TRPV1MAPTALDH1A1HPGD | |
| SCHEMBL25238835 | 0.71 | GPR142 (0.58) | MEN1KMT2ANPC1RAB9AGPR142 | |
| SCHEMBL25212955 | 0.71 | NPC1 (0.58) | MEN1KMT2ANPC1RAB9AGPR142 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2393812-B1 | SUBSTITUTED SPIROAMIDES AS B1R-MODULATORS | GRUENENTHAL GMBH (DE) | 2013-07-03 | — | — | EP | disclosed |
| EP-2393812-A1 | SUBSTITUTED SPIRO-AMIDES AS B1R MODULATORS | Grünenthal GmbH (DE) | 2011-12-14 | — | — | EP | disclosed |
| WO-2010089127-A1 | SUBSTITUTED SPIRO-AMIDES AS B1R MODULATORS | Grünenthal GmbH (DE) | 2010-08-12 | — | — | WO | disclosed |