Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.43 |
| ▸ | RAB9A | P51151 | 4/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | F3 | P13726 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 6/20 | 0.40 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.38 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | F7 | P08709 | 1/20 | 0.36 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.36 |
| ▸ | STAT1 | P42224 | 1/20 | 0.36 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.36 |
| ▸ | RELA | Q04206 | 1/20 | 0.36 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9443356 | 0.91 | NPC1 (0.42) | NPC1RAB9ASMN1; SMN2F3HDAC6 | |
| SCHEMBL9443373 | 0.90 | NPC1 (0.41) | NPC1RAB9ASMN1; SMN2F3HDAC6 | |
| SCHEMBL9306676 | 0.84 | HDAC6 (0.46) | NPC1RAB9ASMN1; SMN2HDAC6DYRK1A | |
| SCHEMBL9443360 | 0.82 | NPC1 (0.41) | NPC1RAB9ASMN1; SMN2HDAC6DYRK1A | |
| SCHEMBL9303830 | 0.82 | HPGD (0.47) | NPC1RAB9ASMN1; SMN2HDAC6HPGD | |
| SCHEMBL8972937 | 0.81 | NPC1 (0.54) | NPC1RAB9ASMN1; SMN2HDAC6DYRK1A | |
| SCHEMBL8972967 | 0.80 | NPC1 (0.52) | NPC1RAB9ASMN1; SMN2HDAC6HPGD | |
| SCHEMBL2856934 | 0.78 | HPGD (0.56) | NPC1RAB9ASMN1; SMN2HPGDPKM | |
| SCHEMBL9443367 | 0.77 | PPARA (0.54) | NPC1RAB9ASMN1; SMN2KDM4EGFER | |
| SCHEMBL9443179 | 0.76 | THRB (0.45) | NPC1RAB9ASMN1; SMN2HDAC6DYRK1A |
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 |