Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.42 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.38 |
| ▸ | ESR1 | P03372 | 1/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL1610644 | 0.86 | MTNR1A (0.49) | MTNR1AMTNR1BCYP19A1 | |
| SCHEMBL2843913 | 0.80 | ALDH1A1 (0.49) | MTNR1AMTNR1BCYP2D6CYP2C19CYP3A4 | |
| SCHEMBL6546410 | 0.80 | ESR1 (0.59) | SMN1; SMN2MTNR1AMTNR1BMEN1KMT2A | |
| SCHEMBL3015704 | 0.79 | ALDH1A1 (0.45) | SMN1; SMN2MTNR1AMTNR1BCYP19A1ESR1 | |
| SCHEMBL10489055 | 0.78 | SLC6A2 (0.55) | SMN1; SMN2MEN1KMT2APSMB5CYP19A1 | |
| SCHEMBL5695557 | 0.77 | MTNR1A (0.40) | SMN1; SMN2MTNR1AMTNR1BMEN1KMT2A | |
| SCHEMBL4973916 | 0.76 | SLC6A2 (0.53) | SMN1; SMN2MEN1KMT2APSMB5CYP19A1 | |
| SCHEMBL9856676 | 0.76 | HTR2A (0.53) | SMN1; SMN2CYP2D6LMNA | |
| SCHEMBL9857294 | 0.76 | HTR2A (0.53) | SMN1; SMN2MTNR1AMTNR1BMEN1KMT2A | |
| SCHEMBL3009093 | 0.75 | ALDH1A1 (0.42) | SMN1; SMN2MTNR1AMTNR1BMEN1KMT2A |
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-1294695-A2 | SUBSTITUTED DIAMIDE DERIVATIVES USEFUL AS MOTILIN ANTAGONISTS | Ortho-McNeil Pharmaceutical, Inc. (US) | 2003-03-26 | — | — | EP | disclosed |
| WO-2001085694-A2 | SUBSTITUTED DIAMIDE DERIVATIVES USEFUL AS MOTILIN ANTAGONISTS | ORTHO-MCNEIL PHARMACEUTICAL, INC. (US) | 2001-11-15 | — | — | WO | disclosed |