Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.61 |
| ▸ | MEN1 | O00255 | 3/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.51 |
| ▸ | MAPT | P10636 | 2/20 | 0.51 |
| ▸ | HPGD | P15428 | 2/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
| ▸ | KMO | O15229 | 1/20 | 0.48 |
| ▸ | GLA | P06280 | 1/20 | 0.47 |
| ▸ | PBRM1 | Q86U86 | 1/20 | 0.47 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.47 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.47 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.47 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.46 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.46 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.46 |
| ▸ | DHODH | Q02127 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL23090497 | 0.84 | KMO (0.65) | KMOPRSS1PRSS2PRSS3DHODH | |
| SCHEMBL13447740 | 0.82 | MAOA (0.90) | MAOAMEN1KDM4EALDH1A1LMNA | |
| SCHEMBL22664854 | 0.82 | MAOA (0.90) | MAOAMEN1KDM4EALDH1A1LMNA | |
| SCHEMBL20908121 | 0.82 | KMO (0.68) | MEN1KMT2AKMOPRSS1PRSS2 | |
| SCHEMBL23090495 | 0.82 | KMO (0.68) | MEN1KMT2AKMOPRSS1PRSS2 | |
| SCHEMBL29932515 | 0.81 | HSD17B10 (0.56) | MAOAMEN1KDM4EALDH1A1LMNA | |
| SCHEMBL29932511 | 0.81 | HSD17B10 (0.54) | MAOAMEN1KDM4EALDH1A1LMNA | |
| SCHEMBL23480192 | 0.80 | PBRM1 (0.69) | MAOAMEN1KDM4EALDH1A1LMNA | |
| SCHEMBL25631780 | 0.80 | MAOA (0.86) | MAOAMEN1KDM4EALDH1A1LMNA | |
| SCHEMBL6797870 | 0.80 | MAOA (0.95) | MAOAMEN1KDM4EALDH1A1LMNA |
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-107188812-B | Diamine compound with aggregation-induced emission group and preparation method and application thereof | 中山大学 | 2022-09-27 | — | — | CN | disclosed |
| CN-107188812-A | A kind of diamine compound with aggregation-induced emission group and its preparation method and application | 中山大学 | 2017-09-22 | — | — | CN | disclosed |