Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTRB1 | P17538 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 3/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.43 |
| ▸ | RIPK1 | Q13546 | 2/20 | 0.43 |
| ▸ | AKT1 | P31749 | 2/20 | 0.43 |
| ▸ | MTOR | P42345 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL22095153 | 0.83 | CYP2C19 (0.47) | MEN1KMT2ANPC1RAB9ACYP2C19 | |
| SCHEMBL5505659 | 0.76 | CTRB1 (0.49) | CTRB1MEN1KMT2ANPC1RAB9A | |
| SCHEMBL22982786 | 0.75 | NPC1 (0.50) | CTRB1MEN1KMT2ANPC1RAB9A | |
| SCHEMBL4154050 | 0.75 | CTRB1 (0.48) | CTRB1MEN1KMT2ANPC1RAB9A | |
| SCHEMBL29151949 | 0.75 | TDP1 (0.50) | CTRB1MEN1KMT2ANPC1RAB9A | |
| SCHEMBL28808224 | 0.75 | CTRB1 (0.50) | CTRB1MEN1KMT2AKCNN4CYP2C19 | |
| SCHEMBL27893366 | 0.74 | MEN1 (0.44) | MEN1KMT2AHTTL3MBTL1 | |
| SCHEMBL28646100 | 0.74 | KDM4A (0.42) | CTRB1MEN1KMT2ANPC1RAB9A | |
| SCHEMBL16884070 | 0.73 | LMNA (0.49) | NPC1RAB9ARECQLL3MBTL1 | |
| SCHEMBL21758682 | 0.73 | LTA4H (0.46) | CTRB1MEN1KMT2ANPC1RAB9A |
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-108341752-B | Amine compound for inhibiting SSAO/VAP-1 and application thereof in medicine | 广东东阳光药业有限公司 | 2022-12-23 | — | — | CN | disclosed |