Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 3/20 | 0.55 |
| ▸ | AGXT | P21549 | 2/20 | 0.55 |
| ▸ | CA1 | P00915 | 2/20 | 0.54 |
| ▸ | CA2 | P00918 | 2/20 | 0.54 |
| ▸ | CALM1 | P0DP23 | 2/20 | 0.50 |
| ▸ | APP | P05067 | 5/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | MAOB | P27338 | 1/20 | 0.47 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.47 |
| ▸ | CA12 | O43570 | 1/20 | 0.46 |
| ▸ | CA7 | P43166 | 1/20 | 0.46 |
| ▸ | CA9 | Q16790 | 1/20 | 0.46 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL4181089 | 0.89 | IDO1 (0.58) | IDO1AGXTCA1CA2CALM1 | |
| SCHEMBL27329 | 0.89 | IDO1 (0.58) | IDO1AGXTCA1CA2CALM1 | |
| SCHEMBL34413 | 0.89 | IDO1 (0.67) | IDO1AGXTCA1CA2CALM1 | |
| Methyl Alcohol SCHEMBL28311094 | 0.87 | IDO1 (0.56) | IDO1AGXTCA1CA2CALM1 | |
| Methoxymethane SCHEMBL28284584 | 0.87 | IDO1 (0.56) | IDO1AGXTCA1CA2CALM1 | |
| SCHEMBL1477048 | 0.87 | IDO1 (0.56) | IDO1AGXTCA1CA2CALM1 | |
| SCHEMBL1475480 | 0.87 | IDO1 (0.56) | IDO1AGXTCA1CA2CALM1 | |
| SCHEMBL1475481 | 0.87 | IDO1 (0.64) | IDO1AGXTCA1CA2CALM1 | |
| Potassium SCHEMBL1477050 | 0.87 | IDO1 (0.64) | IDO1AGXTCA1CA2CALM1 | |
| SCHEMBL5512106 | 0.86 | APP (0.67) | IDO1AGXTAPPHTTNPC1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016202894-A1 | METHOD OF CONVERTING ALCOHOL TO HALIDE | UNIVERSITAET DES SAARLANDES (DE) | 2016-12-22 | — | — | WO | disclosed |