Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.46 |
| ▸ | CTSS | P25774 | 3/20 | 0.46 |
| ▸ | CTSL | P07711 | 2/20 | 0.46 |
| ▸ | CTSB | P07858 | 2/20 | 0.46 |
| ▸ | CTSK | P43235 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.41 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | FLT3 | P36888 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL5257593 | 1.00 | KMT2A (0.46) | KMT2AMEN1RCE1CTSSCTSL | |
| SCHEMBL5262041 | 0.88 | CTSS (0.41) | KMT2AMEN1CTSSCTSLCTSB | |
| SCHEMBL5259094 | 0.88 | CTSS (0.41) | KMT2AMEN1CTSSCTSLCTSB | |
| SCHEMBL6834251 | 0.88 | CTSS (0.41) | KMT2AMEN1CTSSCTSLCTSB | |
| SCHEMBL5261818 | 0.84 | KMT2A (0.47) | KMT2AMEN1RCE1CTSSCTSL | |
| SCHEMBL5255166 | 0.83 | FAAH (0.43) | CTSSCTSKRAB9ANPC1KDM4E | |
| SCHEMBL6838497 | 0.83 | FAAH (0.43) | CTSSCTSKRAB9ANPC1KDM4E | |
| SCHEMBL5254841 | 0.82 | KMT2A (0.54) | KMT2AMEN1RCE1RAB9ANPC1 | |
| SCHEMBL6835018 | 0.82 | KMT2A (0.54) | KMT2AMEN1RCE1RAB9ANPC1 | |
| SCHEMBL6839032 | 0.82 | NPC1 (0.45) | KMT2AMEN1CTSSCTSKRAB9A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6759428-B2 | SUCH AS N-((1,2)-2-(((CYANO(CYCLOPROPYL)METHYL)AMINO)CARBONYL) CYCLOHEXYL)-1H-INDOLE-2-CARBOXAMIDE; CATHEPSIN K INHIBITORS | ROCHE PALO ALTO LLC | 2004-07-06 | — | — | US | disclosed |