Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | ABL1 | P00519 | 3/20 | 0.44 |
| ▸ | NAMPT | P43490 | 1/20 | 0.44 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.43 |
| ▸ | TLR7 | Q9NYK1 | 3/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | GSK3B | P49841 | 1/20 | 0.41 |
| ▸ | CCR9 | P51686 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.40 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.39 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| Bromide SCHEMBL6279968 | 0.99 | ABL1 (0.43) | NPC1RAB9AABL1NAMPTTRPV1 | |
| SCHEMBL7149547 | 0.82 | GSK3B (0.62) | NAMPTTLR7GSK3BEPHX2 | |
| SCHEMBL7140563 | 0.81 | CYP1A2 (0.54) | NPC1RAB9AGSK3BMEN1KMT2A | |
| Bromide SCHEMBL6284163 | 0.81 | GSK3B (0.60) | NAMPTTLR7GSK3BEPHX2 | |
| SCHEMBL5527403 | 0.81 | KMT2A (0.46) | NPC1RAB9ATRPV1MEN1KMT2A | |
| Bromide SCHEMBL6284177 | 0.79 | CYP1A2 (0.53) | NPC1RAB9AGSK3BMEN1KMT2A | |
| SCHEMBL4470958 | 0.79 | LTA4H (0.55) | RAB9AGSK3BMEN1KMT2ASMN1; SMN2 | |
| Bromide SCHEMBL2795481 | 0.77 | LTA4H (0.53) | RAB9AGSK3BMEN1KMT2ASMN1; SMN2 | |
| SCHEMBL3537983 | 0.77 | NPC1 (0.59) | NPC1RAB9AABL1NAMPTTRPV1 | |
| SCHEMBL6695151 | 0.76 | ALDH1A1 (0.36) | NAMPTTDP1KMT2ASMN1; SMN2HSD17B10 |
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-6620825-B1 | 1,3-Azole compound substituted by pyridyl; administering as antiasthmatic, antiinflammatory or antiallergen agents | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 2003-09-16 | — | — | US | disclosed |
| US-6436966-B1 | Adenosine A3 receptor antagonists | TAKEDA CHEMICAL IND., LTD. (JP) | 2002-08-20 | — | — | US | disclosed |