Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 7/20 | 0.62 |
| ▸ | RAB9A | P51151 | 7/20 | 0.62 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.62 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.62 |
| ▸ | PKM | P14618 | 3/20 | 0.62 |
| ▸ | GAA | P10253 | 2/20 | 0.62 |
| ▸ | MAPT | P10636 | 2/20 | 0.62 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.62 |
| ▸ | TP53 | P04637 | 2/20 | 0.62 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.62 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.62 |
| ▸ | RELA | Q04206 | 2/20 | 0.62 |
| ▸ | ATG4B | Q9Y4P1 | 2/20 | 0.62 |
| ▸ | HPGD | P15428 | 1/20 | 0.62 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.62 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.47 |
| ▸ | PIM1 | P11309 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL9384187 | 0.78 | NPC1 (0.72) | NPC1RAB9ASMN1; SMN2KDM4EPKM | |
| SCHEMBL11304291 | 0.77 | NPC1 (0.62) | NPC1RAB9ASMN1; SMN2KDM4EPKM | |
| SCHEMBL30661048 | 0.77 | RAB9A (1.00) | NPC1RAB9ASMN1; SMN2KDM4EPKM | |
| SCHEMBL2894809 | 0.77 | RAB9A (1.00) | NPC1RAB9ASMN1; SMN2KDM4EPKM | |
| SCHEMBL26343307 | 0.76 | CES2 (0.48) | NPC1RAB9ASMN1; SMN2KDM4EPKM | |
| SCHEMBL6255733 | 0.76 | NPC1 (0.59) | NPC1RAB9ASMN1; SMN2KDM4EPKM | |
| SCHEMBL20751787 | 0.76 | CES2 (0.48) | NPC1RAB9ASMN1; SMN2KDM4EPKM | |
| SCHEMBL16429529 | 0.76 | ALDH1A1 (0.50) | NPC1RAB9ASMN1; SMN2KDM4EPKM | |
| Bromide SCHEMBL26677852 | 0.76 | RAB9A (0.96) | NPC1RAB9ASMN1; SMN2KDM4EPKM | |
| Hydrochloric Acid SCHEMBL26677841 | 0.76 | RAB9A (0.96) | NPC1RAB9ASMN1; SMN2KDM4EPKM |
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-4008211-A | Betainic azo dyestuffs containing cobalt in complex union with a colorless, tridentate ligand | CIBA-GEIGY AG (CH) | 1977-02-15 | — | — | US | claimed |
| US-4008211-A | Betainic azo dyestuffs containing cobalt in complex union with a colorless, tridentate ligand | CIBA-GEIGY AG (CH) | 1977-02-15 | — | — | US | disclosed |