Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD1 | P21728 | 2/20 | 0.42 |
| ▸ | IDO1 | P14902 | 1/20 | 0.39 |
| ▸ | MAT2A | P31153 | 5/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.33 |
| ▸ | BACE1 | P56817 | 1/20 | 0.31 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8962726 | 1.00 | DRD1 (0.42) | DRD1IDO1MAT2ANPC1RAB9A | |
| SCHEMBL8963101 | 0.96 | IDO1 (0.41) | DRD1IDO1MAT2ANPC1RAB9A | |
| SCHEMBL8963111 | 0.96 | IDO1 (0.41) | DRD1IDO1MAT2ANPC1RAB9A | |
| SCHEMBL9543548 | 0.94 | IDO1 (0.39) | DRD1IDO1MAT2ANPC1RAB9A | |
| SCHEMBL8963275 | 0.92 | IDO1 (0.39) | DRD1IDO1MAT2ANPC1RAB9A | |
| SCHEMBL8963147 | 0.88 | IDO1 (0.40) | DRD1IDO1MAT2AHDAC2 | |
| SCHEMBL8963151 | 0.88 | IDO1 (0.40) | DRD1IDO1MAT2AHDAC2 | |
| SCHEMBL8963104 | 0.82 | JAK2 (0.34) | — | |
| SCHEMBL8963112 | 0.82 | JAK2 (0.34) | — | |
| SCHEMBL8963003 | 0.81 | DRD2 (0.42) | NPC1RAB9AKMT2AMEN1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0559860-B1 | HALOVINYL-DERIVATIVES | HOFFMANN LA ROCHE (CH) | 1996-02-14 | — | — | EP | disclosed |
| US-5364556-A | Halovinyl-derivatives | HOFFMANN-LA ROCHE INC. (US) | 1994-11-15 | — | — | US | disclosed |