Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTNR1A | P48039 | 5/20 | 0.46 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.46 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.46 |
| ▸ | MTNR1B | P49286 | 4/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | PARP1 | P09874 | 1/20 | 0.42 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.42 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.42 |
| ▸ | PARP4 | Q9UKK3 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7203389 | 0.94 | ALOX5 (0.48) | MTNR1AHDAC3HDAC1HDAC2MTNR1B | |
| SCHEMBL7209241 | 0.94 | ALOX5 (0.48) | MTNR1AHDAC3HDAC1HDAC2MTNR1B | |
| SCHEMBL6675870 | 0.87 | HDAC3 (0.45) | MTNR1AHDAC3HDAC1HDAC2MTNR1B | |
| SCHEMBL1990568 | 0.86 | HPSE (0.51) | MTNR1AHDAC3HDAC1HDAC2MTNR1B | |
| SCHEMBL1350452 | 0.86 | ALDH1A1 (0.54) | MTNR1AHDAC3HDAC1HDAC2MTNR1B | |
| SCHEMBL11013421 | 0.85 | KDM4E (0.49) | KDM4ENPC1RAB9ACA1CA2 | |
| SCHEMBL10822663 | 0.85 | KDM4E (0.49) | KDM4ENPC1RAB9ACA1CA2 | |
| SCHEMBL29625514 | 0.84 | TAAR1 (0.58) | KDM4ENPC1RAB9ACA1CA2 | |
| SCHEMBL1987832 | 0.82 | PPARA (0.56) | HDAC3HDAC1HDAC2 | |
| SCHEMBL15569140 | 0.81 | KMT2A (0.51) | MTNR1AMTNR1BKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| CN-104761420-A | Method of synthesizing amide with methyl aromatics and amine in water phase | UNIV JIANGXI NORMAL | 2015-07-08 | — | — | CN | disclosed |