Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR4A2 | P43354 | 2/20 | 0.47 |
| ▸ | MAOB | P27338 | 7/20 | 0.43 |
| ▸ | MAOA | P21397 | 6/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | SLC26A4 | O43511 | 1/20 | 0.42 |
| ▸ | RXRA | P19793 | 2/20 | 0.41 |
| ▸ | RXRB | P28702 | 2/20 | 0.41 |
| ▸ | RXRG | P48443 | 2/20 | 0.41 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.41 |
| ▸ | PPARA | Q07869 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | PPARD | Q03181 | 1/20 | 0.40 |
| ▸ | HPD | P32754 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | SENP8 | Q96LD8 | 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 | |
|---|---|---|---|---|
| SCHEMBL7221889 | 0.90 | NR4A2 (0.48) | NR4A2MAOBMAOAKMT2ARXRA | |
| SCHEMBL7216505 | 0.89 | NPC1 (0.46) | NR4A2MAOBMAOAKMT2ASLC26A4 | |
| SCHEMBL7223004 | 0.88 | SMN1; SMN2 (0.43) | NR4A2KMT2ARXRARXRBRXRG | |
| SCHEMBL7216554 | 0.86 | HRH3 (0.43) | NR4A2KMT2ARXRARXRBRXRG | |
| SCHEMBL7222916 | 0.85 | RXRB (0.37) | NR4A2MAOBMAOAKMT2ARXRA | |
| SCHEMBL7221445 | 0.84 | FFAR1 (0.39) | NR4A2RXRARXRBRXRGMRGPRX4 | |
| SCHEMBL7215961 | 0.83 | HRH3 (0.39) | NR4A2KMT2ARXRARXRBRXRG | |
| SCHEMBL7218103 | 0.83 | NR4A2 (0.49) | NR4A2MAOBMAOAKMT2ASLC26A4 | |
| SCHEMBL7222219 | 0.83 | S1PR1 (0.41) | RXRARXRBRXRGMRGPRX4NPC1 | |
| SCHEMBL7216431 | 0.81 | MRGPRX4 (0.50) | MAOBMRGPRX4NPC1RAB9APPARD |
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-6627651-B1 | Exhibiting preventive and therapeutic effects against HIV infectious diseases wherein R1 is an optionally substituted five- or six-membered ring group; X1 is a free valency or the like; W is a divalent group and inhibitors of HIV (human | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 2003-09-30 | — | — | US | disclosed |
| EP-1182195-A1 | CYCLIC COMPOUNDS AND USES THEREOF | Takeda Chemical Industries, Ltd. (JP) | 2002-02-27 | — | — | EP | disclosed |