Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM2 | Q14416 | 1/20 | 0.38 |
| ▸ | GRM3 | Q14832 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | ARG1 | P05089 | 1/20 | 0.30 |
| ▸ | ARG2 | P78540 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL497762 | 0.81 | GRM2 (0.46) | GRM2GRM3ALDH1A1MEN1CYP1A2 | |
| SCHEMBL30651 | 0.81 | ALDH1A1 (0.42) | ALDH1A1TSHRMEN1CYP1A2THRB | |
| SCHEMBL5904292 | 0.78 | ALDH1A1 (0.50) | GRM2GRM3ALDH1A1TSHRMEN1 | |
| SCHEMBL28015998 | 0.76 | — | — | |
| SCHEMBL31147030 | 0.76 | TSHR (0.36) | GRM2GRM3ALDH1A1TSHRHTT | |
| Hydrochloric Acid SCHEMBL3620842 | 0.76 | ALDH1A1 (0.48) | GRM2GRM3ALDH1A1TSHRMEN1 | |
| SCHEMBL30787966 | 0.75 | ARG2 (0.41) | ALDH1A1TSHRMEN1CYP1A2THRB | |
| SCHEMBL563056 | 0.75 | CYP1A2 (0.52) | GRM2GRM3ALDH1A1MEN1CYP1A2 | |
| SCHEMBL3100826 | 0.75 | GRM2 (0.42) | GRM2GRM3ALDH1A1MEN1CYP1A2 | |
| SCHEMBL3100821 | 0.75 | GRM2 (0.42) | GRM2GRM3ALDH1A1MEN1CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5268476-A | Substituted 10bH-oxazolo[3,2-c] [1,3] benzoxazine-2(3H), 5-diones | ABBOTT LABORATORIES (US) | 1993-12-07 | — | — | US | disclosed |
| US-5153358-A | Process for the preparation of alpha-alkylated alpha-amino acids and alpha-halogenated alpha-amino acids | ABBOTT LABORATORIES (US) | 1992-10-06 | — | — | US | disclosed |