Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 3/20 | 0.59 |
| ▸ | CDYL2 | Q8N8U2 | 1/20 | 0.47 |
| ▸ | CDYL | Q9Y232 | 1/20 | 0.47 |
| ▸ | CDY1; CDY1B | Q9Y6F8 | 1/20 | 0.47 |
| ▸ | ASAH1 | Q13510 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | KMO | O15229 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | PSMB8 | P28062 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9715974 | 0.90 | IDO1 (0.47) | IDO1CDYL2CDYLCDY1; CDY1BASAH1 | |
| SCHEMBL10507200 | 0.85 | IDO1 (0.63) | IDO1CDYL2CDYLCDY1; CDY1BASAH1 | |
| SCHEMBL9715935 | 0.79 | IDO1 (0.61) | IDO1KMO | |
| SCHEMBL9716028 | 0.79 | MIF (0.57) | ALDH1A1 | |
| SCHEMBL9715947 | 0.76 | KMO (0.60) | IDO1CDYL2CDYLCDY1; CDY1BKMO | |
| SCHEMBL5423077 | 0.76 | IDO1 (0.62) | IDO1CDYL2CDYLCDY1; CDY1BASAH1 | |
| SCHEMBL9715940 | 0.75 | KMO (0.58) | CDYL2CDYLCDY1; CDY1BKMOALDH1A1 | |
| SCHEMBL9715986 | 0.75 | KMO (0.43) | IDO1KMOALDH1A1 | |
| SCHEMBL9715945 | 0.75 | KMO (0.58) | IDO1ASAH1CYP1A2KMOALDH1A1 | |
| SCHEMBL2061822 | 0.75 | IDO1 (0.64) | IDO1CDYL2CDYLCDY1; CDY1BASAH1 |
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-5102898-A | Halosubstituted alkyne group; fungicides | ROHM AND HAAS COMPANY (US) | 1992-04-07 | — | — | US | disclosed |