Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.54 |
| ▸ | MEN1 | O00255 | 2/20 | 0.54 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.54 |
| ▸ | RAB9A | P51151 | 2/20 | 0.53 |
| ▸ | POLB | P06746 | 2/20 | 0.53 |
| ▸ | NPC1 | O15118 | 1/20 | 0.53 |
| ▸ | FLT3 | P36888 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.48 |
| ▸ | MAPT | P10636 | 3/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | PKM | P14618 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.48 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.48 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.48 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.48 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.48 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.48 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL5254841 | 1.00 | KMT2A (0.54) | KMT2AMEN1RCE1RAB9APOLB | |
| SCHEMBL15506662 | 0.88 | TAS1R3 (0.55) | KMT2AMEN1RCE1RAB9APOLB | |
| SCHEMBL27539143 | 0.85 | KDM4E (0.48) | KMT2AMEN1RCE1RAB9APOLB | |
| SCHEMBL5260619 | 0.85 | KDM4E (0.48) | KMT2AMEN1RCE1RAB9APOLB | |
| SCHEMBL29063142 | 0.83 | RAB9A (0.61) | KMT2AMEN1RCE1RAB9APOLB | |
| SCHEMBL5257593 | 0.82 | KMT2A (0.46) | KMT2AMEN1RCE1RAB9APOLB | |
| SCHEMBL6838467 | 0.82 | KMT2A (0.46) | KMT2AMEN1RCE1RAB9APOLB | |
| SCHEMBL6833096 | 0.81 | KMT2A (0.47) | KMT2AMEN1RCE1RAB9APOLB | |
| SCHEMBL27558367 | 0.78 | CCKBR (0.57) | RAB9ANPC1FLT3KDM4EMAPT | |
| SCHEMBL5256019 | 0.78 | CCKBR (0.57) | RAB9ANPC1FLT3KDM4EMAPT |
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-6747053-B2 | Heteroaryl nitriles | ROCHE PALO ALTO LLC | 2004-06-08 | — | — | US | disclosed |