Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 2/20 | 0.47 |
| ▸ | ASAH1 | Q13510 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CDYL2 | Q8N8U2 | 1/20 | 0.39 |
| ▸ | CDYL | Q9Y232 | 1/20 | 0.39 |
| ▸ | CDY1; CDY1B | Q9Y6F8 | 1/20 | 0.39 |
| ▸ | APEX1 | P27695 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MIF | P14174 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 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 | |
|---|---|---|---|---|
| SCHEMBL9715932 | 0.90 | IDO1 (0.59) | IDO1ASAH1CYP1A2CDYL2CDYL | |
| SCHEMBL3043360 | 0.80 | CYP1A2 (0.60) | IDO1ASAH1CYP1A2CDYL2CDYL | |
| SCHEMBL536309 | 0.79 | TDP1 (0.47) | IDO1MAPTKMT2ALMNAMIF | |
| SCHEMBL9716002 | 0.79 | MIF (0.44) | IDO1ASAH1KMT2AMIFNPC1 | |
| SCHEMBL9715990 | 0.79 | NPC1 (0.57) | ASAH1CDYL2CDYLCDY1; CDY1BAPEX1 | |
| SCHEMBL9716052 | 0.79 | MIF (0.57) | MEN1KMT2ALMNAMIF | |
| SCHEMBL9716010 | 0.75 | MET (0.51) | CDYL2CDYLCDY1; CDY1BMAPTKMT2A | |
| SCHEMBL9715963 | 0.75 | KMO (0.46) | ASAH1CYP1A2APEX1MAPTMEN1 | |
| SCHEMBL30806471 | 0.75 | IDO1 (0.64) | IDO1ASAH1MIFNPC1 | |
| SCHEMBL2060899 | 0.75 | IDO1 (0.51) | IDO1ASAH1CYP1A2APEX1 |
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 |