Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 2/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.53 |
| ▸ | ESR1 | P03372 | 3/20 | 0.50 |
| ▸ | MAPT | P10636 | 5/20 | 0.49 |
| ▸ | TSHR | P16473 | 5/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 2/20 | 0.48 |
| ▸ | RAB9A | P51151 | 2/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL28832577 | 0.86 | ESR1 (0.65) | MAOBKDM4EESR1MAPTALDH1A1 | |
| SCHEMBL28085659 | 0.84 | ESR1 (0.58) | MAOBKDM4EESR1MAPTALDH1A1 | |
| SCHEMBL28085701 | 0.80 | MAOB (0.56) | MAOBKDM4EESR1MAPTALDH1A1 | |
| SCHEMBL28085657 | 0.76 | MAOB (0.52) | MAOBKDM4EESR1MAPTALDH1A1 | |
| SCHEMBL28085670 | 0.74 | ESR1 (0.73) | ESR1MAPTMEN1KMT2ANPC1 | |
| SCHEMBL11485562 | 0.74 | MAOB (1.00) | MAOBKDM4EMAPTALDH1A1MEN1 | |
| Flavonol SCHEMBL7691888 | 0.73 | KDM4E (0.72) | MAOBKDM4EMAPTTSHRALDH1A1 | |
| SCHEMBL10001286 | 0.73 | SMN1; SMN2 (0.67) | KDM4EMAPTTSHRALDH1A1MEN1 | |
| SCHEMBL28085548 | 0.73 | ESR1 (0.73) | KDM4EESR1MAPTALDH1A1MEN1 | |
| SCHEMBL7117054 | 0.72 | MAOB (0.72) | MAOBKDM4EMAPTALDH1A1KMT2A |
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-105801544-A | 3-aryl-4-arylamine-coumarin derivative and preparing method and medical application thereof | 中国药科大学 | 2016-07-27 | — | — | CN | disclosed |