Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 13/20 | 0.43 |
| ▸ | NR1H3 | Q13133 | 13/20 | 0.43 |
| ▸ | MLYCD | O95822 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | AR | P10275 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | RORA | P35398 | 1/20 | 0.36 |
| ▸ | RORC | P51449 | 1/20 | 0.36 |
| ▸ | RORB | Q92753 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL827480 | 0.77 | — | — | |
| SCHEMBL6315499 | 0.76 | — | — | |
| SCHEMBL30295392 | 0.75 | ESR1 (0.42) | — | |
| SCHEMBL18407899 | 0.75 | — | — | |
| SCHEMBL3385140 | 0.73 | PDK2 (0.48) | NR1H2NR1H3MLYCDRORARORC | |
| SCHEMBL131990 | 0.73 | NR1H2 (0.68) | NR1H2NR1H3MLYCDSMN1; SMN2 | |
| SCHEMBL18885491 | 0.73 | — | — | |
| SCHEMBL2975836 | 0.73 | — | — | |
| SCHEMBL25710862 | 0.73 | CHRM3 (0.33) | — | |
| Formic Acid SCHEMBL27883763 | 0.71 | CES2 (0.35) | MEN1TSHRKMT2A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9267908-B2 | Devices and methods for determination of species including chemical warfare agents | MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) | 2016-02-23 | — | — | US | disclosed |
| US-20160011135-A1 | DEVICES AND METHODS FOR DETERMINATION OF SPECIES INCLUDING CHEMICAL WARFARE AGENTS | MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) | 2016-01-14 | — | — | US | disclosed |
| US-8951473-B2 | Devices and methods for determination of species including chemical warfare agents | MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) | 2015-02-10 | — | — | US | disclosed |
| US-20110089051-A1 | DEVICES AND METHODS FOR DETERMINATION OF SPECIES INCLUDING CHEMICAL WARFARE AGENTS | MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) | 2011-04-21 | — | — | US | disclosed |