Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 5/20 | 0.52 |
| ▸ | NPC1 | O15118 | 3/20 | 0.52 |
| ▸ | MEN1 | O00255 | 4/20 | 0.47 |
| ▸ | GPR183 | P32249 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | BLM | P54132 | 1/20 | 0.43 |
| ▸ | APP | P05067 | 4/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.43 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.43 |
| ▸ | PTGDR2 | Q9Y5Y4 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8434968 | 0.99 | KMT2A (0.52) | KMT2ANPC1MEN1GPR183KDM4E | |
| SCHEMBL8437426 | 0.93 | KMT2A (0.52) | KMT2ANPC1MEN1GPR183KDM4E | |
| Hydrochloric Acid SCHEMBL8440804 | 0.93 | KMT2A (0.52) | KMT2ANPC1MEN1GPR183KDM4E | |
| SCHEMBL8439752 | 0.83 | KMT2A (0.58) | KMT2ANPC1MEN1GPR183KDM4E | |
| SCHEMBL9416631 | 0.81 | KMT2A (0.76) | KMT2ANPC1MEN1GPR183KDM4E | |
| Hydrochloric Acid SCHEMBL8804718 | 0.79 | S1PR1 (0.40) | KMT2ANPC1MEN1GPR183KDM4E | |
| SCHEMBL8436351 | 0.79 | KMT2A (0.58) | KMT2ANPC1MEN1GPR183KDM4E | |
| SCHEMBL8437842 | 0.77 | FFAR1 (0.48) | KMT2ANPC1MEN1RAB9ACYP1A2 | |
| SCHEMBL8439233 | 0.77 | FFAR1 (0.48) | KMT2ANPC1MEN1RAB9ACYP1A2 | |
| Hydrochloric Acid SCHEMBL8434272 | 0.77 | FFAR1 (0.47) | KMT2ANPC1MEN1RAB9ACYP1A2 |
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 |