Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAAA | Q02083 | 1/20 | 0.44 |
| ▸ | CLPP | Q16740 | 2/20 | 0.43 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.43 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.43 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.43 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.43 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.42 |
| ▸ | CAPN1 | P07384 | 3/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.41 |
| ▸ | CTSG | P08311 | 1/20 | 0.41 |
| ▸ | CTRB1 | P17538 | 1/20 | 0.41 |
| ▸ | CMA1 | P23946 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.41 |
| ▸ | NPFFR1 | Q9GZQ6 | 1/20 | 0.41 |
| ▸ | NPFFR2 | Q9Y5X5 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7657278 | 0.90 | CLPP (0.44) | CLPPCHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL7666903 | 0.84 | KDM4E (0.47) | NAAAPRSS1CTSGCTRB1CMA1 | |
| SCHEMBL7428183 | 0.83 | LTB4R2 (0.44) | CLPPCHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL7689953 | 0.82 | CHRNB2 (0.52) | CHRNB2CHRNB4CHRNA3CHRNA4CAPN1 | |
| SCHEMBL7694185 | 0.82 | CAPN1 (0.56) | NAAACAPN1CA2PRSS1CTSG | |
| SCHEMBL7428250 | 0.81 | KCNA5 (0.44) | CLPPKCNA5CAPN1CA2MEN1 | |
| SCHEMBL7393060 | 0.78 | NAAA (0.48) | NAAACLPPCHRNB2CHRNB4CHRNA3 | |
| SCHEMBL7693965 | 0.78 | CAPN1 (0.46) | NAAACAPN1MEN1KMT2ANPC1 | |
| SCHEMBL7697322 | 0.77 | CAPN1 (0.54) | CAPN1TACR3 | |
| SCHEMBL7693912 | 0.75 | CAPN1 (0.73) | CAPN1KMT2AMAPK14 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6436925-B1 | BETTER ABLE TO CROSS MEMBRANES; INHIBITORS OF CYSTEINE PROTEASES LIKE CALPAIN I AND II AND CATHEPSIN B AND L, CAN THUS BE USED TO CONTROL DISEASES ASSOCIATED WITH AN ELEVATED ACTIVITY OF CALPAIN ENZYMES OR CATHEPSIN ENZYMES | ABBOTT LABORATORIES | 2002-08-20 | — | — | US | disclosed |