Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 10/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 10/20 | 0.58 |
| ▸ | NPC1 | O15118 | 9/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.58 |
| ▸ | HPGD | P15428 | 8/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 8/20 | 0.58 |
| ▸ | HSD17B10 | Q99714 | 6/20 | 0.58 |
| ▸ | TP53 | P04637 | 4/20 | 0.58 |
| ▸ | CASP3 | P42574 | 3/20 | 0.54 |
| ▸ | SENP7 | Q9BQF6 | 3/20 | 0.54 |
| ▸ | SENP6 | Q9GZR1 | 3/20 | 0.54 |
| ▸ | SENP8 | Q96LD8 | 2/20 | 0.54 |
| ▸ | POLB | P06746 | 1/20 | 0.54 |
| ▸ | MAPT | P10636 | 6/20 | 0.50 |
| ▸ | NFKB1 | P19838 | 5/20 | 0.49 |
| ▸ | NFKB2 | Q00653 | 5/20 | 0.49 |
| ▸ | RELA | Q04206 | 5/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.49 |
| ▸ | GAA | P10253 | 2/20 | 0.47 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL10045319 | 0.80 | NPC1 (0.62) | RAB9AKDM4ENPC1ALDH1A1HPGD | |
| SCHEMBL9105844 | 0.79 | NPC1 (0.61) | RAB9AKDM4ENPC1ALDH1A1HPGD | |
| SCHEMBL28602639 | 0.79 | MAPT (0.47) | RAB9AKDM4ENPC1SMN1; SMN2HSD17B10 | |
| SCHEMBL30011535 | 0.79 | MAPT (0.47) | RAB9AKDM4ENPC1SMN1; SMN2HSD17B10 | |
| SCHEMBL903255 | 0.79 | NPC1 (0.61) | RAB9AKDM4ENPC1ALDH1A1HPGD | |
| SCHEMBL29442076 | 0.79 | NPC1 (0.61) | RAB9AKDM4ENPC1ALDH1A1HPGD | |
| Iodide SCHEMBL8417295 | 0.78 | NPC1 (0.59) | RAB9AKDM4ENPC1ALDH1A1HPGD | |
| SCHEMBL24133264 | 0.76 | RAB9A (0.58) | RAB9AKDM4ENPC1ALDH1A1HPGD | |
| SCHEMBL8346086 | 0.76 | NPC1 (0.58) | RAB9AKDM4ENPC1ALDH1A1HPGD | |
| SCHEMBL137387 | 0.76 | RAB9A (0.58) | RAB9AKDM4ENPC1ALDH1A1HPGD |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5347008-A | Thio(cyclo) alkanepolycarboxylic acids containing heterocyclic substituents | CIBA-GEIGY CORPORATION (US) | 1994-09-13 | — | — | US | disclosed |
| US-5152929-A | Corrosion inhibitors for water systems | CIBA-GEIGY CORPORATION (US) | 1992-10-06 | — | — | US | disclosed |
| EP-0129506-A2 | Heterocyclically substituted thio(cyclo)alkane polycarboxylic acids | CIBA-GEIGY AG (CH) | 1984-12-27 | — | — | EP | disclosed |