Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.54 |
| ▸ | RAB9A | P51151 | 1/20 | 0.54 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | MGLL | Q99685 | 1/20 | 0.46 |
| ▸ | CTSG | P08311 | 2/20 | 0.45 |
| ▸ | CMA1 | P23946 | 1/20 | 0.45 |
| ▸ | DRD4 | P21917 | 3/20 | 0.44 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.44 |
| ▸ | CAPN1 | P07384 | 1/20 | 0.44 |
| ▸ | CTSB | P07858 | 1/20 | 0.44 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | CA7 | P43166 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | HTT | P42858 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL8291195 | 0.78 | MGLL (0.59) | NPC1RAB9ATSHRHPGDMGLL | |
| SCHEMBL11986399 | 0.73 | NPC1 (0.72) | NPC1RAB9ATSHRHPGDMGLL | |
| SCHEMBL7302754 | 0.73 | NPC1 (0.72) | NPC1RAB9ATSHRHPGDMGLL | |
| SCHEMBL10282916 | 0.71 | NPC1 (0.74) | NPC1RAB9ATSHRHPGDMGLL | |
| SCHEMBL10197837 | 0.71 | NPC1 (0.69) | NPC1RAB9ATSHRHPGDMGLL | |
| Hydrochloric Acid SCHEMBL4618408 | 0.70 | NPC1 (0.72) | NPC1RAB9ATSHRHPGDMGLL | |
| SCHEMBL4310722 | 0.69 | TSHR (0.84) | NPC1RAB9ATSHRHPGDDRD4 | |
| SCHEMBL7303743 | 0.69 | NPC1 (0.65) | NPC1RAB9ATSHRHPGDMGLL | |
| SCHEMBL12911161 | 0.69 | TSHR (0.69) | NPC1RAB9ATSHRKMT2AGAA | |
| SCHEMBL408393 | 0.68 | NPC1 (0.72) | NPC1RAB9ATSHRHPGDMGLL |
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 |
|---|---|---|---|---|---|---|---|
| EP-1716160-B1 | NOVEL INHIBITORS OF CHYMASE | JANSSEN PHARMACEUTICA NV (BE) | 2010-12-29 | — | — | EP | disclosed |