Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMPD1 | P17405 | 3/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | TUBB1 | Q9H4B7 | 1/20 | 0.40 |
| ▸ | S1PR2 | O95136 | 6/20 | 0.38 |
| ▸ | S1PR1 | P21453 | 6/20 | 0.38 |
| ▸ | S1PR3 | Q99500 | 5/20 | 0.38 |
| ▸ | LPAR2 | Q9HBW0 | 5/20 | 0.38 |
| ▸ | S1PR4 | O95977 | 2/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.38 |
| ▸ | CNR2 | P34972 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | PRKDC | P78527 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | TLR4 | O00206 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL469391 | 0.91 | NPC1 (0.41) | NPC1RAB9ASMN1; SMN2TUBB1L3MBTL1 | |
| SCHEMBL455647 | 0.85 | LMNA (0.46) | SMN1; SMN2TUBB1L3MBTL1ALDH1A1PRKDC | |
| SCHEMBL6798339 | 0.83 | CNR2 (0.44) | SMPD1NPC1RAB9ASMN1; SMN2TUBB1 | |
| SCHEMBL148284 | 0.80 | PRKDC (0.48) | TUBB1ALDH1A1PRKDCMAPT | |
| SCHEMBL636327 | 0.79 | NPC1 (0.61) | NPC1RAB9ASMN1; SMN2L3MBTL1ALDH1A1 | |
| SCHEMBL5903298 | 0.79 | MEN1 (0.45) | NPC1RAB9ASMN1; SMN2TUBB1L3MBTL1 | |
| SCHEMBL2821669 | 0.78 | NPC1 (0.60) | NPC1RAB9ASMN1; SMN2L3MBTL1ALDH1A1 | |
| SCHEMBL5723153 | 0.78 | KDM4E (0.43) | NPC1RAB9ASMN1; SMN2TUBB1L3MBTL1 | |
| SCHEMBL455237 | 0.78 | HTR1A (0.43) | NPC1RAB9ASMN1; SMN2TUBB1L3MBTL1 | |
| SCHEMBL8085009 | 0.76 | CNR2 (0.52) | SMPD1S1PR3CNR2MAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-6017919-A | Compounds and pharmaceutical use thereof | JAPAN TOBACCO INC. (JP) | 2000-01-25 | — | — | US | disclosed |
| EP-0887340-A1 | NOVEL COMPOUNDS AND PHARMACEUTICAL USE THEREOF | Japan Tobacco Inc. (JP) | 1998-12-30 | — | — | EP | disclosed |