Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 6/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 6/20 | 0.47 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 5/20 | 0.41 |
| ▸ | HDAC10 | Q969S8 | 5/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 5/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 5/20 | 0.41 |
| ▸ | HDAC4 | P56524 | 4/20 | 0.41 |
| ▸ | HDAC7 | Q8WUI4 | 4/20 | 0.41 |
| ▸ | HDAC11 | Q96DB2 | 4/20 | 0.41 |
| ▸ | HDAC9 | Q9UKV0 | 4/20 | 0.41 |
| ▸ | HDAC5 | Q9UQL6 | 4/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | FAAH | O00519 | 1/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | ALPL | P05186 | 1/20 | 0.39 |
| ▸ | ALPI | P09923 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL19442485 | 0.89 | KDM5B (0.41) | HDAC3HDAC1HDAC2HDAC10HDAC8 | |
| SCHEMBL17511304 | 0.84 | HDAC3 (0.47) | HDAC3HDAC1HIF1ASMN1; SMN2HDAC2 | |
| SCHEMBL19440878 | 0.84 | SMN1; SMN2 (0.47) | HDAC3HDAC1HIF1ASMN1; SMN2HDAC2 | |
| SCHEMBL19440809 | 0.83 | NPC1 (0.56) | HDAC3HDAC1HIF1ASMN1; SMN2HDAC2 | |
| SCHEMBL19440838 | 0.81 | KMT2A (0.50) | HIF1ASMN1; SMN2KMT2ANPC1RAB9A | |
| SCHEMBL19440861 | 0.81 | KMT2A (0.47) | HDAC3HDAC1SMN1; SMN2HDAC2HDAC10 | |
| SCHEMBL19440793 | 0.81 | HIF1A (0.42) | HDAC3HDAC1HIF1ASMN1; SMN2HDAC2 | |
| SCHEMBL19440807 | 0.80 | HDAC3 (0.46) | HDAC3HDAC1HIF1ASMN1; SMN2HDAC2 | |
| SCHEMBL19440847 | 0.80 | OPRM1 (0.55) | NPC1RAB9AHTR2AMAPT | |
| SCHEMBL19440802 | 0.80 | HIF1A (0.43) | HDAC3HDAC1HIF1ASMN1; SMN2HDAC2 |
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-9783510-B2 | Small molecule mediated transcriptional induction of E-cadherin | VANDERBILT UNIVERSITY (US) | 2017-10-10 | — | — | US | disclosed |
| US-9783510-B2 | Small molecule mediated transcriptional induction of E-cadherin | VANDERBILT UNIVERSITY (US) | 2017-10-10 | — | — | US | disclosed |