Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 2/20 | 0.44 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | MMP3 | P08254 | 2/20 | 0.42 |
| ▸ | MMP2 | P08253 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | MGLL | Q99685 | 2/20 | 0.39 |
| ▸ | MMP1 | P03956 | 1/20 | 0.38 |
| ▸ | MMP9 | P14780 | 1/20 | 0.38 |
| ▸ | MMP13 | P45452 | 1/20 | 0.38 |
| ▸ | ESR1 | P03372 | 1/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.37 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.37 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.37 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.37 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.37 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL17860078 | 0.87 | HDAC1 (0.43) | HDAC1HDAC2KMT2AALDH1A1HSD17B10 | |
| SCHEMBL17971135 | 0.87 | HDAC1 (0.43) | HDAC1HDAC2KMT2AALDH1A1HSD17B10 | |
| SCHEMBL16848626 | 0.86 | HDAC1 (0.45) | HDAC1HDAC2KMT2AALDH1A1HSD17B10 | |
| SCHEMBL16848628 | 0.86 | HDAC1 (0.45) | HDAC1HDAC2KMT2AALDH1A1HSD17B10 | |
| SCHEMBL16848624 | 0.86 | HDAC1 (0.45) | HDAC1HDAC2KMT2AALDH1A1HSD17B10 | |
| SCHEMBL16848638 | 0.84 | HDAC1 (0.42) | HDAC1HDAC2KMT2AALDH1A1HSD17B10 | |
| SCHEMBL16848629 | 0.84 | HDAC1 (0.42) | HDAC1HDAC2KMT2AALDH1A1HSD17B10 | |
| SCHEMBL16748118 | 0.84 | HDAC1 (0.42) | HDAC1HDAC2KMT2AALDH1A1HSD17B10 | |
| SCHEMBL16582523 | 0.82 | HDAC1 (0.47) | HDAC1HDAC2KMT2AALDH1A1MMP3 | |
| SCHEMBL16848620 | 0.82 | HDAC1 (0.59) | HDAC1HDAC2KMT2AALDH1A1HSD17B10 |
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-20160222293-A1 | MESOGENIC COMPOUNDS AND MESOGENIC MEDIA | MERCK PATENT GMBH (DE) | 2016-08-04 | — | — | US | disclosed |
| US-20160222293-A1 | MESOGENIC COMPOUNDS AND MESOGENIC MEDIA | MERCK PATENT GMBH (DE) | 2016-08-04 | — | — | US | disclosed |