Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.50 |
| ▸ | TSHR | P16473 | 3/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.50 |
| ▸ | RAB9A | P51151 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | TP53 | P04637 | 1/20 | 0.50 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.50 |
| ▸ | RELA | Q04206 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | AR | P10275 | 1/20 | 0.47 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.46 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.46 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL8438001 | 0.95 | NAAA (0.50) | NPC1TSHRSMN1; SMN2RAB9AMAPT | |
| SCHEMBL8440100 | 0.91 | TSHR (0.52) | NPC1TSHRSMN1; SMN2RAB9AMAPT | |
| SCHEMBL8437394 | 0.88 | FKBP1A (0.48) | NPC1TSHRSMN1; SMN2MAPK1HSD17B10 | |
| SCHEMBL8440011 | 0.88 | NAAA (0.50) | NPC1TSHRSMN1; SMN2RAB9AMAPT | |
| SCHEMBL8438036 | 0.87 | HDAC3 (0.51) | NPC1TSHRSMN1; SMN2RAB9AMAPT | |
| SCHEMBL8435607 | 0.83 | NAAA (0.50) | NPC1TAAR1HDAC3HDAC1HDAC10 | |
| SCHEMBL8440001 | 0.82 | RAB9A (0.49) | NPC1TSHRSMN1; SMN2RAB9AMAPK1 | |
| SCHEMBL27463063 | 0.82 | NAMPT (0.65) | HPGDALDH1A1NAMPT | |
| SCHEMBL8436143 | 0.82 | PREP (0.48) | NPC1RAB9AENPP2TDP1HDAC3 | |
| SCHEMBL8435346 | 0.82 | MEN1 (0.41) | TSHRSMN1; SMN2HSD17B10HPGDALDH1A1 |
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-5998433-A | THERAPY FOR HYPERLIPIDEMIA; ATHEROSCLEROSIS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1999-12-07 | — | — | US | disclosed |
| CN-1160403-A | Substd. heterobicyclic alkyl amines and their use as squalene oxide cyclase inhibitors | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 1997-09-24 | — | — | CN | disclosed |