Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.35 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.35 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | KCNJ6 | P48051 | 1/20 | 0.33 |
| ▸ | KCNJ5 | P48544 | 1/20 | 0.33 |
| ▸ | KCNJ3 | P48549 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | FAAH | O00519 | 1/20 | 0.33 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL5014395 | 0.78 | RAB9A (0.43) | CHRM3RAB9AKMT2AMEN1NPC1 | |
| SCHEMBL16175735 | 0.70 | KMT2A (0.43) | CHRM2CHRM1CHRM3KMT2AL3MBTL1 | |
| SCHEMBL4040957 | 0.65 | ALDH1A1 (0.43) | SMN1; SMN2LMNARAB9AKMT2AMEN1 | |
| SCHEMBL7501046 | 0.64 | HTT (0.55) | SMN1; SMN2LMNARAB9AKMT2AMEN1 | |
| SCHEMBL5012923 | 0.63 | KMT2A (0.46) | KMT2AL3MBTL1 | |
| SCHEMBL4037290 | 0.63 | ALDH1A1 (0.38) | SMN1; SMN2KMT2AALDH1A1KDM4ETSHR | |
| SCHEMBL16175520 | 0.63 | HTT (0.43) | LMNARAB9AKMT2ANPC1HTT | |
| SCHEMBL1189089 | 0.61 | HTT (0.55) | SMN1; SMN2LMNARAB9AKMT2AMEN1 | |
| SCHEMBL21059271 | 0.60 | L3MBTL1 (0.53) | SMN1; SMN2CHRM3LMNARAB9AKMT2A | |
| SCHEMBL3359614 | 0.60 | KMT2A (0.54) | SMN1; SMN2LMNARAB9AKMT2AMEN1 |
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-1888596-A1 | SUBSTITUTED SPIRO COMPOUNDS AND THEIR USE FOR PRODUCING PAIN-RELIEF MEDICAMENTS | Grünenthal GmbH (DE) | 2008-02-20 | — | — | EP | claimed |
| WO-2006122770-A1 | SUBSTITUTED SPIRO COMPOUNDS AND THEIR USE FOR PRODUCING PAIN-RELIEF MEDICAMENTS | Grünenthal GmbH (DE) | 2006-11-23 | — | — | WO | claimed |