Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CALM1 | P0DP23 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.48 |
| ▸ | TSHR | P16473 | 4/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | IDO1 | P14902 | 3/20 | 0.45 |
| ▸ | LOXL2 | Q9Y4K0 | 2/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.45 |
| ▸ | MAOB | P27338 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.43 |
| ▸ | CASP1 | P29466 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Trimethylammonium SCHEMBL28358083 | 0.89 | TSHR (0.50) | CALM1TDP1TSHRALDH1A1TP53 | |
| SCHEMBL3899948 | 0.77 | ADH1B (0.40) | CALM1TDP1TSHRALDH1A1IDO1 | |
| SCHEMBL28882809 | 0.77 | ALDH1A1 (0.48) | CALM1TDP1TSHRALDH1A1IDO1 | |
| SCHEMBL22541636 | 0.75 | — | — | |
| SCHEMBL21467451 | 0.75 | — | — | |
| SCHEMBL7929243 | 0.75 | — | — | |
| SCHEMBL29066682 | 0.75 | — | — | |
| SCHEMBL275277 | 0.73 | CALM1 (0.43) | CALM1TDP1TSHRALDH1A1IDO1 | |
| SCHEMBL24685830 | 0.69 | TP53 (0.42) | CALM1TDP1TSHRALDH1A1IDO1 | |
| SCHEMBL24136073 | 0.69 | TP53 (0.42) | CALM1TDP1TSHRALDH1A1IDO1 |
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 12 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113493474-A | Condensed-cyclic compound and organic light-emitting element including same | 三星显示有限公司 | 2021-10-12 | — | — | CN | claimed |
| CN-115598945-A | Toner for developing electrostatic image, method for producing the same, image forming method using the same, image forming system, and output | 柯尼卡美能达株式会社（JP） | 2023-01-13 | — | — | CN | disclosed |
| CN-113493474-A | Condensed-cyclic compound and organic light-emitting element including same | 三星显示有限公司 | 2021-10-12 | — | — | CN | disclosed |
| EP-1819647-B1 | METHOD FOR HYDROGENATION OF , -UNSATURATED CARBONYL COMPOUNDS | STUDIENGESELLSCHAFT KOHLE MBH (DE) | 2009-11-18 | — | — | EP | disclosed |
| US-4304614-A | AMMUNITION, DYNAMIC LASERS, FUSES, WELDING | WALKER FRANKLIN E | 1981-12-08 | — | — | US | disclosed |
| US-4196026-A | LOW MOLECULAR WEIGHT | WALKER FRANKLIN E | 1980-04-01 | — | — | US | disclosed |
| US-4129586-A | Peroxide free radical initiators containing ultraviolet light stabilizing groups | PENNWALT CORPORATION (US) | 1978-12-12 | — | — | US | disclosed |
| US-4055714-A | POLYMERIZATION CATALYSTS | PENNWALT CORPORATION (US) | 1977-10-25 | — | — | US | disclosed |
| US-4045427-A | POLYMERIZATION CATALYSTS | PENNWALT CORPORATION (US) | 1977-08-30 | — | — | US | disclosed |
| US-4045426-A | POLYMERIZATION CATALYSTS | PENNWALT CORPORATION (US) | 1977-08-30 | — | — | US | disclosed |
| US-4042773-A | REACTION WITH POLYMERS | PENNWALT CORPORATION (US) | 1977-08-16 | — | — | US | disclosed |
| US-3956269-A | POLYMERIZATION CATALYSTS | PENNWALT CORPORATION (US) | 1976-05-11 | — | — | US | disclosed |