Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 2/20 | 0.52 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.52 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.52 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.52 |
| ▸ | TACR2 | P21452 | 1/20 | 0.50 |
| ▸ | CAPN1 | P07384 | 1/20 | 0.48 |
| ▸ | CLPP | Q16740 | 2/20 | 0.46 |
| ▸ | ITGB1 | P05556 | 2/20 | 0.45 |
| ▸ | ITGA4 | P13612 | 2/20 | 0.45 |
| ▸ | ITGB7 | P26010 | 2/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | CTSS | P25774 | 3/20 | 0.44 |
| ▸ | CTSK | P43235 | 3/20 | 0.44 |
| ▸ | TACR3 | P29371 | 1/20 | 0.43 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.43 |
| ▸ | CTSB | P07858 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | CTSL | P07711 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7689953 | 0.88 | CHRNB2 (0.52) | CHRNB2CHRNB4CHRNA3CHRNA4TACR2 | |
| SCHEMBL7695358 | 0.83 | CHRNB2 (0.47) | CHRNB2CHRNB4CHRNA3CHRNA4TACR2 | |
| SCHEMBL7657278 | 0.83 | CLPP (0.44) | CHRNB2CHRNB4CHRNA3CHRNA4TACR2 | |
| SCHEMBL7694696 | 0.81 | KDM4E (0.47) | ITGB1ITGA4ITGB7HTTKMT2A | |
| SCHEMBL7690823 | 0.81 | CAPN1 (0.60) | CAPN1KMT2ACTSSCTSKCTSB | |
| SCHEMBL7704469 | 0.80 | KCNA5 (0.52) | CHRNB2CHRNB4CHRNA3CHRNA4TACR2 | |
| SCHEMBL3641713 | 0.79 | CAPN1 (0.60) | CHRNB2CHRNB4CHRNA3CHRNA4TACR2 | |
| SCHEMBL3642696 | 0.79 | CAPN1 (0.60) | CHRNB2CHRNB4CHRNA3CHRNA4TACR2 | |
| SCHEMBL3642692 | 0.79 | CAPN1 (0.60) | CHRNB2CHRNB4CHRNA3CHRNA4TACR2 | |
| SCHEMBL6939927 | 0.78 | CAPN1 (0.55) | CHRNB2CHRNB4CHRNA3CHRNA4TACR2 |
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 |