Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.50 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.50 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | MMP3 | P08254 | 1/20 | 0.42 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | PYCR1 | P32322 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA4 | P22748 | 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 | |
|---|---|---|---|---|
| SCHEMBL77549 | 0.97 | CYP1A2 (0.52) | CYP1A2CYP1A1CYP1B1ALDH1A1TAAR1 | |
| Fluoride SCHEMBL27604190 | 0.95 | CYP1A2 (0.50) | CYP1A2CYP1A1CYP1B1ALDH1A1TAAR1 | |
| Biphenyl SCHEMBL28621540 | 0.89 | ALDH1A1 (0.53) | CYP1A2CYP1A1CYP1B1ALDH1A1TAAR1 | |
| Phenylacetylene SCHEMBL29010743 | 0.89 | APP (0.45) | CYP1A2CYP1A1CYP1B1ALDH1A1TAAR1 | |
| SCHEMBL6347456 | 0.89 | EGLN2 (0.44) | CYP1A2CYP1A1CYP1B1ALDH1A1CYP3A4 | |
| Biphenyl SCHEMBL27577179 | 0.86 | ALDH1A1 (0.50) | CYP1A2CYP1A1CYP1B1ALDH1A1TAAR1 | |
| SCHEMBL6752540 | 0.86 | CYP1A1 (0.48) | CYP1A2CYP1A1CYP1B1ALDH1A1TDP1 | |
| SCHEMBL139848 | 0.86 | HDAC8 (0.50) | CYP1A2CYP1A1CYP1B1MMP3KEAP1 | |
| SCHEMBL139611 | 0.86 | HDAC8 (0.50) | CYP1A2CYP1A1CYP1B1MMP3KEAP1 | |
| SCHEMBL10160387 | 0.84 | CYP1A2 (0.42) | CYP1A2CYP1A1CYP1B1ALDH1A1TAAR1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102881296-B | Optical data carrier records method and the optical data carrier of data | 通用电气公司 | 2016-07-06 | — | — | CN | claimed |
| CN-102881296-B | Optical data carrier records method and the optical data carrier of data | 通用电气公司 | 2016-07-06 | — | — | CN | disclosed |
| CN-104903960-A | Stacked film reflective layers for multi-layer optical data storage | GEN ELECTRIC | 2015-09-09 | — | — | CN | disclosed |