Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 13/20 | 0.46 |
| ▸ | THRB | P10828 | 1/20 | 0.46 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.41 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9443179 | 0.92 | THRB (0.45) | HDAC6THRBDYRK1ASMN1; SMN2NPC1 | |
| SCHEMBL9443189 | 0.91 | HDAC6 (0.44) | HDAC6THRBDYRK1ASMN1; SMN2NPC1 | |
| SCHEMBL9306573 | 0.84 | NPC1 (0.43) | HDAC6DYRK1ASMN1; SMN2NPC1RAB9A | |
| SCHEMBL9443181 | 0.84 | THRB (0.44) | HDAC6THRBDYRK1ASMN1; SMN2NPC1 | |
| SCHEMBL9303830 | 0.81 | HPGD (0.47) | HDAC6SMN1; SMN2NPC1RAB9A | |
| SCHEMBL9306437 | 0.78 | NPC1 (0.61) | DYRK1ASMN1; SMN2NPC1RAB9AHDAC1 | |
| SCHEMBL9443185 | 0.78 | PPARA (0.54) | THRBDYRK1A | |
| SCHEMBL9304603 | 0.78 | LDHA (0.45) | SMN1; SMN2NPC1RAB9A | |
| SCHEMBL2856934 | 0.78 | HPGD (0.56) | SMN1; SMN2NPC1RAB9APKM | |
| SCHEMBL8972937 | 0.78 | NPC1 (0.54) | HDAC6DYRK1ASMN1; SMN2NPC1RAB9A |
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 2 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 |