Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 6/20 | 0.65 |
| ▸ | NPC1 | O15118 | 4/20 | 0.65 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.65 |
| ▸ | SCN4A | P35499 | 1/20 | 0.65 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 5/20 | 0.41 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.41 |
| ▸ | NOD2 | Q9HC29 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.39 |
| ▸ | PARP15 | Q460N3 | 1/20 | 0.39 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.39 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.39 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.39 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.37 |
| ▸ | TYR | P14679 | 1/20 | 0.36 |
| ▸ | SCN10A | Q9Y5Y9 | 1/20 | 0.35 |
| ▸ | HTR6 | P50406 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL11782940 | 0.83 | RAB9A (0.46) | RAB9ANPC1SMN1; SMN2SCN4AMEN1 | |
| SCHEMBL798519 | 0.80 | RAB9A (0.67) | RAB9ANPC1SMN1; SMN2SCN4AMEN1 | |
| SCHEMBL2609433 | 0.80 | SMN1; SMN2 (0.67) | RAB9ANPC1SMN1; SMN2SCN4AMEN1 | |
| SCHEMBL15801269 | 0.79 | RAB9A (0.65) | RAB9ANPC1SMN1; SMN2SCN4AMEN1 | |
| SCHEMBL19398571 | 0.79 | RAB9A (0.65) | RAB9ANPC1SMN1; SMN2SCN4AMEN1 | |
| SCHEMBL1309315 | 0.79 | RAB9A (1.00) | RAB9ANPC1SMN1; SMN2SCN4AMEN1 | |
| Isobutane SCHEMBL8357971 | 0.77 | HTT (0.54) | MAPTL3MBTL1GAAAPPHTT | |
| SCHEMBL21025994 | 0.76 | RAB9A (0.61) | RAB9ANPC1SMN1; SMN2SCN4AMEN1 | |
| SCHEMBL20890069 | 0.76 | RAB9A (0.61) | RAB9ANPC1SMN1; SMN2SCN4AMEN1 | |
| SCHEMBL13201319 | 0.76 | NPC1 (0.61) | RAB9ANPC1SMN1; SMN2SCN4AMEN1 |
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 4 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-B1 | HETEROCYCLICALLY SUBSTITUTED THIO(CYCLO)ALKANE POLYCARBOXYLIC ACIDS | CIBA-GEIGY AG (CH) | 1991-03-06 | — | — | EP | disclosed |
| EP-0129506-A2 | Heterocyclically substituted thio(cyclo)alkane polycarboxylic acids | CIBA-GEIGY AG (CH) | 1984-12-27 | — | — | EP | disclosed |