Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 5/20 | 0.45 |
| ▸ | FTO | Q9C0B1 | 2/20 | 0.45 |
| ▸ | MAOB | P27338 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | EGFR | P00533 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.37 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.37 |
| ▸ | CDK7 | P50613 | 1/20 | 0.37 |
| ▸ | CDK9 | P50750 | 1/20 | 0.37 |
| ▸ | CCNH | P51946 | 1/20 | 0.37 |
| ▸ | MNAT1 | P51948 | 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 | |
|---|---|---|---|---|
| SCHEMBL29875889 | 0.94 | MAOA (0.45) | MAOAFTOMAOBHPGDALDH1A1 | |
| SCHEMBL275378 | 0.94 | MAOA (0.45) | MAOAFTOMAOBHPGDALDH1A1 | |
| Toluene SCHEMBL28185032 | 0.81 | MAOA (0.40) | MAOAFTOMAOBHPGDALDH1A1 | |
| Formaldehyde SCHEMBL11763625 | 0.71 | IDO1 (0.61) | HPGDALDH1A1CYP3A4HSD17B10KDM4E | |
| SCHEMBL275377 | 0.71 | MAOA (0.50) | MAOAFTOMAOBHPGDALDH1A1 | |
| SCHEMBL289214 | 0.71 | MAOA (0.45) | MAOAFTOMAOBHPGDALDH1A1 | |
| 1-Naphthol SCHEMBL29215642 | 0.71 | CYP1A2 (0.63) | MAOAFTOMAOBHPGDHSD17B10 | |
| 1-Naphthol SCHEMBL17580890 | 0.71 | CYP1A2 (0.63) | MAOAFTOMAOBHPGDHSD17B10 | |
| SCHEMBL269277 | 0.69 | MAOB (0.49) | MAOAFTOMAOBHPGDALDH1A1 | |
| SCHEMBL30111795 | 0.69 | HTR2B (0.50) | MAOAFTOMAOBHPGDALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-106432137-A | Histone acetyltransferase modulators and uses thereof | 纽约市哥伦比亚大学理事会 | 2017-02-22 | — | — | CN | disclosed |
| CN-103347392-B | Histone acetyltransferase modulators and uses thereof | 纽约市哥伦比亚大学理事会 | 2016-10-12 | — | — | CN | disclosed |