Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 5/20 | 0.64 |
| ▸ | NPC1 | O15118 | 1/20 | 0.60 |
| ▸ | RAB9A | P51151 | 1/20 | 0.60 |
| ▸ | CCNK | O75909 | 1/20 | 0.52 |
| ▸ | CDK12 | Q9NYV4 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.50 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.50 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.50 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.50 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.50 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.50 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.50 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.50 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.50 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.50 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.50 |
| ▸ | FLT3 | P36888 | 1/20 | 0.50 |
| ▸ | GSK3B | P49841 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL22510634 | 0.83 | CYP19A1 (0.82) | CYP19A1NPC1RAB9ACCNKCDK12 | |
| SCHEMBL29275462 | 0.83 | CYP19A1 (0.66) | CYP19A1NPC1RAB9ACCNKCDK12 | |
| SCHEMBL22868021 | 0.82 | HDAC8 (0.53) | CYP19A1NPC1RAB9ACCNKCDK12 | |
| SCHEMBL29275460 | 0.81 | EPHB4 (0.70) | CYP19A1NPC1RAB9ACCNKCDK12 | |
| SCHEMBL22868022 | 0.81 | HDAC8 (0.55) | CYP19A1NPC1RAB9AHDAC8HDAC6 | |
| SCHEMBL28202461 | 0.81 | HDAC8 (0.52) | CYP19A1NPC1RAB9AALDH1A1LMNA | |
| SCHEMBL26874441 | 0.81 | CYP19A1 (0.59) | CYP19A1NPC1RAB9ACCNKCDK12 | |
| SCHEMBL27818294 | 0.79 | CYP19A1 (0.60) | CYP19A1NPC1RAB9ACCNKCDK12 | |
| SCHEMBL15836586 | 0.78 | CYP19A1 (0.93) | CYP19A1NPC1RAB9AHDAC8HDAC6 | |
| SCHEMBL935182 | 0.78 | CYP19A1 (1.00) | CYP19A1NPC1RAB9AHDAC8HDAC6 |
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-112275322-B | Preparation method and application of supported CNTs @ NHC-Cu catalytic material | 中国科学院兰州化学物理研究所 | 2022-01-25 | — | — | CN | disclosed |
| CN-112275322-A | Preparation method and application of supported CNTs @ NHC-Cu catalytic material | 中国科学院兰州化学物理研究所 | 2021-01-29 | — | — | CN | disclosed |