Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.59 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.55 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.55 |
| ▸ | ADRB3 | P13945 | 2/20 | 0.55 |
| ▸ | PRKCA | P17252 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 3/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | SCN1A | P35498 | 1/20 | 0.50 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.50 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.47 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL227395 | 0.97 | ALDH1A1 (0.62) | ALDH1A1ADRB2ADRB1ADRB3PRKCA | |
| SCHEMBL16019900 | 0.97 | ALDH1A1 (0.62) | ALDH1A1ADRB2ADRB1ADRB3PRKCA | |
| SCHEMBL12559135 | 0.95 | ALDH1A1 (0.61) | ALDH1A1ADRB2ADRB1ADRB3PRKCA | |
| SCHEMBL2618310 | 0.95 | ALDH1A1 (0.61) | ALDH1A1ADRB2ADRB1ADRB3PRKCA | |
| SCHEMBL16217637 | 0.95 | ALDH1A1 (0.61) | ALDH1A1ADRB2ADRB1ADRB3PRKCA | |
| Propene SCHEMBL1458261 | 0.92 | ALDH1A1 (0.54) | ALDH1A1ADRB2ADRB1ADRB3PRKCA | |
| SCHEMBL16876662 | 0.92 | LMNA (0.57) | ALDH1A1ADRB2ADRB1ADRB3PRKCA | |
| Ethylene Glycol SCHEMBL524375 | 0.92 | ALDH1A1 (0.62) | ALDH1A1ADRB2ADRB1ADRB3PRKCA | |
| SCHEMBL14707364 | 0.90 | PDCD1 (0.61) | ALDH1A1ADRB2ADRB1ADRB3PRKCA | |
| SCHEMBL15512256 | 0.90 | ALDH1A1 (0.56) | ALDH1A1ADRB2ADRB1ADRB3PRKCA |
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 |
|---|---|---|---|---|---|---|---|
| US-4256856-A | A CROSSLINKED ELASTIC ETHYLENE-HEXAFLUOROPROPYLENE COPOLYMER HAVING RESISTANCE TO URANIUM HEXAFLUORIDE; SEALANTS, LININGS, PACKING; SHOCKPROOF | JAPAN ATOMIC ENERGY RESEARCH INSTITUTE (JP) | 1981-03-17 | — | — | US | disclosed |