Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.42 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL29018034 | 0.98 | ALDH1A1 (0.41) | ALDH1A1TSHRATMNPSR1RAB9A | |
| SCHEMBL29018046 | 0.98 | ALDH1A1 (0.41) | ALDH1A1TSHRATMNPSR1RAB9A | |
| SCHEMBL28694203 | 0.88 | RAB9A (0.46) | ALDH1A1TSHRATMNPSR1RAB9A | |
| SCHEMBL7190397 | 0.84 | GPR84 (0.52) | ALDH1A1TSHRATMNPSR1RAB9A | |
| SCHEMBL28051882 | 0.83 | HTR2A (0.56) | ALDH1A1TSHRATMNPSR1RAB9A | |
| SCHEMBL28051728 | 0.83 | HTR2A (0.56) | ALDH1A1TSHRATMNPSR1RAB9A | |
| SCHEMBL28825910 | 0.83 | HTR2A (0.56) | ALDH1A1TSHRATMNPSR1RAB9A | |
| SCHEMBL28051879 | 0.83 | HTR2A (0.56) | ALDH1A1TSHRATMNPSR1RAB9A | |
| SCHEMBL5012393 | 0.83 | HTR2A (0.56) | ALDH1A1TSHRATMNPSR1RAB9A | |
| SCHEMBL28051684 | 0.83 | HTR2A (0.56) | ALDH1A1TSHRATMNPSR1RAB9A |
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-112341606-A | Compound, preparation method thereof and quantum dot light-emitting diode | 广东聚华印刷显示技术有限公司 | 2021-02-09 | — | — | CN | claimed |
| CN-112341606-A | Compound, preparation method thereof and quantum dot light-emitting diode | 广东聚华印刷显示技术有限公司 | 2021-02-09 | — | — | CN | disclosed |