Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR3 | O14843 | 2/20 | 0.59 |
| ▸ | TSHR | P16473 | 3/20 | 0.46 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | OR51E2 | Q9H255 | 1/20 | 0.35 |
| ▸ | GABRP | O00591 | 2/20 | 0.35 |
| ▸ | GABRD | O14764 | 2/20 | 0.35 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.35 |
| ▸ | GABRB1 | P18505 | 2/20 | 0.35 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.35 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.35 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.35 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.35 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.35 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.35 |
| ▸ | GABRA4 | P48169 | 2/20 | 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 | |
|---|---|---|---|---|
| Propionic Acid SCHEMBL28448613 | 0.89 | FFAR3 (0.53) | FFAR3TSHRHDAC3HDAC1HDAC2 | |
| Isobutanol SCHEMBL11138179 | 0.85 | FFAR3 (0.62) | FFAR3TSHRHDAC3HDAC1HDAC2 | |
| Bicarbonate SCHEMBL6933680 | 0.84 | TSHR (0.45) | TSHRTDP1OR51E2TP53 | |
| Propylene Glycol SCHEMBL181936 | 0.82 | TDP1 (0.59) | FFAR3TSHRHDAC3HDAC1HDAC2 | |
| Malonic Acid SCHEMBL30288586 | 0.82 | LDHA (0.53) | FFAR3TSHRTDP1ALDH1A1OR51E2 | |
| Propylene Glycol SCHEMBL1490297 | 0.82 | TDP1 (0.59) | FFAR3TSHRHDAC3HDAC1HDAC2 | |
| Succinic Acid SCHEMBL18691126 | 0.82 | LMNA (0.53) | FFAR3TSHRHDAC3HDAC1HDAC2 | |
| Propylene Glycol SCHEMBL28013216 | 0.82 | TDP1 (0.59) | FFAR3TSHRHDAC3HDAC1HDAC2 | |
| Acetic Acid SCHEMBL9756915 | 0.81 | FFAR3 (0.47) | FFAR3TSHRTDP1ALDH1A1OR51E2 | |
| Butyric Acid SCHEMBL9756919 | 0.81 | FFAR3 (0.65) | FFAR3TSHRHDAC3HDAC1HDAC2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0316374-B1 | OPTICALLY ACTIVE COMPOUNDS | F. HOFFMANN-LA ROCHE AG (CH) | 1991-07-31 | — | — | EP | disclosed |
| EP-0316374-A1 | OPTICALLY ACTIVE COMPOUNDS. | HOFFMANN LA ROCHE (CH) | 1989-05-24 | — | — | EP | disclosed |
| WO-1988008838-A1 | OPTICALLY ACTIVE COMPOUNDS | F. HOFFMANN-LA ROCHE & CO. AKTIENGESELLSCHAFT (CH) | 1988-11-17 | — | — | WO | disclosed |