Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | ACHE | P22303 | 1/20 | 0.42 |
| ▸ | DRD2 | P14416 | 2/20 | 0.40 |
| ▸ | DRD1 | P21728 | 2/20 | 0.40 |
| ▸ | DRD4 | P21917 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | TACR1 | P25103 | 2/20 | 0.37 |
| ▸ | CYP2A13 | Q16696 | 1/20 | 0.36 |
| ▸ | GBA1 | P04062 | 1/20 | 0.36 |
| ▸ | CCR3 | P51677 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL27870913 | 0.70 | CHRNB2 (0.48) | ALDH1A1ACHEDRD2DRD1GAA | |
| SCHEMBL27850987 | 0.67 | ACHE (0.47) | CYP2D6ACHEGAAKMT2ACYP2A13 | |
| SCHEMBL9533940 | 0.67 | CHRNA7 (0.51) | ACHEGAAKMT2ATACR1CYP2A13 | |
| SCHEMBL15692576 | 0.66 | ACHE (0.50) | ACHEDRD2DRD1DRD4KMT2A | |
| SCHEMBL31438264 | 0.65 | ALDH1A1 (0.48) | CYP2D6ALDH1A1ACHEDRD2DRD1 | |
| SCHEMBL7049331 | 0.65 | ALDH1A1 (0.48) | CYP2D6ALDH1A1ACHEDRD2DRD1 | |
| SCHEMBL28335494 | 0.65 | ALDH1A1 (0.48) | CYP2D6ALDH1A1ACHEDRD2DRD1 | |
| SCHEMBL19447557 | 0.64 | ACHE (0.44) | ALDH1A1ACHEGAAKMT2ACYP2A13 | |
| SCHEMBL15888659 | 0.64 | RAB9A (0.42) | CYP2D6ACHEGAAKMT2AGBA1 | |
| SCHEMBL13162969 | 0.64 | HTR6 (0.57) | — |
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-0550587-A1 | STEREOSELECTIVE PREPARATION OF ACID SENSITIVE AMIDES AND INTERMEDIATES USEFUL IN SAID PREPARATION | RHONE-POULENC RORER INTERNATIONAL (HOLDINGS) INC. (US) | 1993-07-14 | — | — | EP | claimed |
| WO-1992005146-A1 | STEREOSELECTIVE PREPARATION OF ACID SENSITIVE AMIDES AND INTERMEDIATES USEFUL IN SAID PREPARATION | RHONE-POULENC RORER INTERNATIONAL (HOLDINGS) INC. (US) | 1992-04-02 | — | — | WO | claimed |