Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.32 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.32 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.32 |
| ▸ | KDM4D | Q6B0I6 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | CETP | P11597 | 2/20 | 0.31 |
| ▸ | CNR1 | P21554 | 1/20 | 0.31 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL17986558 | 1.00 | HDAC1 (0.38) | HDAC1HDAC6TP53MAPTTHRB | |
| SCHEMBL16629717 | 1.00 | HDAC1 (0.38) | HDAC1HDAC6TP53MAPTTHRB | |
| SCHEMBL16618957 | 1.00 | HDAC1 (0.38) | HDAC1HDAC6TP53MAPTTHRB | |
| SCHEMBL18017427 | 0.92 | ADRB1 (0.34) | HDAC1CHRNB2CHRNA7CHRNA4HSD17B10 | |
| SCHEMBL21278534 | 0.92 | ADRB1 (0.34) | HDAC1CHRNB2CHRNA7CHRNA4HSD17B10 | |
| SCHEMBL16619734 | 0.92 | ADRB1 (0.34) | HDAC1CHRNB2CHRNA7CHRNA4HSD17B10 | |
| SCHEMBL21268138 | 0.92 | ADRB1 (0.34) | HDAC1CHRNB2CHRNA7CHRNA4HSD17B10 | |
| SCHEMBL21278308 | 0.92 | ADRB1 (0.34) | HDAC1CHRNB2CHRNA7CHRNA4HSD17B10 | |
| SCHEMBL18017469 | 0.92 | ADRB1 (0.34) | HDAC1CHRNB2CHRNA7CHRNA4HSD17B10 | |
| SCHEMBL16619958 | 0.92 | ADRB1 (0.34) | HDAC1CHRNB2CHRNA7CHRNA4HSD17B10 |
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-9486448-B2 | Pyrrolidine derived beta 3 adrenergic receptor agonists | MERCK SHARP & DOHME CORP. (US) | 2016-11-08 | — | — | US | disclosed |