Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRND | Q07001 | 9/20 | 0.45 |
| ▸ | CHRNA1 | P02708 | 5/20 | 0.45 |
| ▸ | CHRNG | P07510 | 5/20 | 0.45 |
| ▸ | CHRNB1 | P11230 | 5/20 | 0.45 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.43 |
| ▸ | NPY1R | P25929 | 3/20 | 0.40 |
| ▸ | CTSL | P07711 | 1/20 | 0.38 |
| ▸ | NMT2 | O60551 | 4/20 | 0.38 |
| ▸ | NMT1 | P30419 | 4/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9203094 | 0.78 | CHRND (0.54) | CHRNDCHRNA1CHRNGCHRNB1GRIA1 | |
| SCHEMBL8123411 | 0.78 | NPY1R (0.57) | CHRNDCHRNA1CHRNGCHRNB1GRIA1 | |
| SCHEMBL8114445 | 0.77 | NPY1R (0.48) | CHRNDCHRNA1CHRNGCHRNB1GRIA1 | |
| SCHEMBL8526218 | 0.77 | NPY1R (0.48) | NPY1R | |
| SCHEMBL8125986 | 0.77 | NPY1R (0.60) | CHRNDCHRNA1CHRNGCHRNB1GRIA1 | |
| SCHEMBL8127300 | 0.74 | NPY1R (0.47) | CHRNDCHRNA1CHRNGCHRNB1NPY1R | |
| SCHEMBL8583802 | 0.73 | KDM4E (0.48) | — | |
| SCHEMBL9199366 | 0.72 | TLR2 (0.33) | — | |
| SCHEMBL8119581 | 0.71 | NPY1R (0.40) | NPY1R | |
| Hydrochloric Acid SCHEMBL8526277 | 0.70 | NOS1 (0.35) | — |
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-0885186-A1 | AMINO ACID DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THESE COMPOUNDS AND PROCESSES FOR PREPARING THEM | Dr. Karl Thomae GmbH (DE) | 1998-12-23 | — | — | EP | disclosed |
| WO-1997019911-A1 | AMINO ACID DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THESE COMPOUNDS AND PROCESSES FOR PREPARING THEM | DR. KARL THOMAE GMBH (DE) | 1997-06-05 | — | — | WO | disclosed |