Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | KIF11 | P52732 | 1/20 | 0.44 |
| ▸ | GSK3B | P49841 | 1/20 | 0.44 |
| ▸ | KIT | P10721 | 1/20 | 0.42 |
| ▸ | SRC | P12931 | 1/20 | 0.42 |
| ▸ | FLT3 | P36888 | 1/20 | 0.42 |
| ▸ | ITK | Q08881 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 4/20 | 0.41 |
| ▸ | NPC1 | O15118 | 3/20 | 0.41 |
| ▸ | RAB9A | P51151 | 3/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.41 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.41 |
| ▸ | RELA | Q04206 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
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 SCHEMBL6280874 | 0.98 | ALDH1A1 (0.43) | ALDH1A1TSHRHSD17B10KIF11GSK3B | |
| SCHEMBL6619666 | 0.94 | ALDH1A1 (0.44) | ALDH1A1TSHRHSD17B10KIF11GSK3B | |
| Bromide SCHEMBL6545831 | 0.92 | ALDH1A1 (0.43) | ALDH1A1TSHRHSD17B10KIF11GSK3B | |
| Bromide SCHEMBL6600773 | 0.87 | MAPT (0.39) | ALDH1A1TSHRHSD17B10KIF11GSK3B | |
| SCHEMBL7149547 | 0.86 | GSK3B (0.62) | KIF11GSK3BSRD5A2NAMPTHIF1A | |
| Bromide SCHEMBL6284163 | 0.84 | GSK3B (0.60) | KIF11GSK3BSRD5A2NAMPTHIF1A | |
| SCHEMBL7143608 | 0.82 | RAB9A (0.53) | ALDH1A1KIF11MAPTNPC1RAB9A | |
| SCHEMBL7147231 | 0.82 | ALDH1A1 (0.42) | ALDH1A1GSK3BITKNPC1RAB9A | |
| Bromide SCHEMBL6282388 | 0.81 | RAB9A (0.52) | ALDH1A1KIF11MAPTNPC1RAB9A | |
| SCHEMBL21990365 | 0.81 | ALDH1A1 (0.48) | ALDH1A1TSHRHSD17B10GSK3BHDAC1 |
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 |