Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIN1 | Q13526 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | MMP8 | P22894 | 2/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 4/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | MDM4 | O15151 | 1/20 | 0.36 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.36 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.36 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.36 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 4/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | KCNN4 | O15554 | 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 | |
|---|---|---|---|---|
| SCHEMBL5311804 | 0.75 | MAPT (0.42) | SMN1; SMN2MAPTMEN1KMT2A | |
| SCHEMBL4185722 | 0.75 | MAPT (0.42) | SMN1; SMN2MAPTMEN1KMT2A | |
| SCHEMBL4640323 | 0.75 | CHRM2 (0.48) | PIN1ALDH1A1MMP8RECQLSMN1; SMN2 | |
| SCHEMBL1975199 | 0.74 | PIN1 (0.44) | PIN1ALDH1A1MMP8RECQLSMN1; SMN2 | |
| SCHEMBL16732173 | 0.71 | PIN1 (0.50) | PIN1ALDH1A1MMP8RECQLSMN1; SMN2 | |
| SCHEMBL12588967 | 0.71 | PIN1 (0.46) | PIN1ALDH1A1MMP8RECQLSMN1; SMN2 | |
| SCHEMBL27576669 | 0.70 | PIN1 (0.45) | PIN1ALDH1A1MMP8RECQLSMN1; SMN2 | |
| SCHEMBL21119495 | 0.69 | PIN1 (0.42) | PIN1ALDH1A1MMP8RECQLSMN1; SMN2 | |
| SCHEMBL11128706 | 0.67 | KCNN4 (0.45) | SMN1; SMN2MAPTLMNAMEN1KMT2A | |
| SCHEMBL9037241 | 0.67 | KCNN4 (0.45) | SMN1; SMN2MAPTLMNAMEN1KMT2A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5756812-A | Process for the preparation of pure (S,S)-N-(1-ethoxycarbonyl-3-phenylpropyl) alanine | DSM CHEMIE LINZ GMBH (AT) | 1998-05-26 | — | — | US | disclosed |