Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPY5R | Q15761 | 3/20 | 0.49 |
| ▸ | TSHR | P16473 | 2/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | KCNT1 | Q5JUK3 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | CXCR6 | O00574 | 1/20 | 0.48 |
| ▸ | DRD4 | P21917 | 2/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL15624940 | 1.00 | NPY5R (0.49) | NPY5RTSHRSMN1; SMN2KCNT1ALDH1A1 | |
| SCHEMBL8232663 | 0.82 | SMN1; SMN2 (0.52) | NPY5RSMN1; SMN2ALDH1A1DRD4LMNA | |
| SCHEMBL23389107 | 0.81 | KMT2A (0.55) | ALDH1A1KDM4EMEN1KMT2APOLB | |
| SCHEMBL23389106 | 0.81 | KMT2A (0.55) | ALDH1A1KDM4EMEN1KMT2APOLB | |
| SCHEMBL15630650 | 0.78 | POLB (0.55) | TSHRSMN1; SMN2KCNT1ALDH1A1DRD4 | |
| SCHEMBL30880018 | 0.77 | MAP4K4 (0.49) | USP30 | |
| SCHEMBL2559118 | 0.76 | KCNT1 (0.53) | TSHRSMN1; SMN2KCNT1ALDH1A1DRD4 | |
| SCHEMBL18419028 | 0.76 | KMT2A (0.50) | USP30KMT2A | |
| SCHEMBL20960362 | 0.75 | CA1 (0.52) | NPY5RKDM4EKMT2ACYP2C9 | |
| SCHEMBL15624978 | 0.75 | CA1 (0.52) | NPY5RKDM4EKMT2ACYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2897940-B1 | HETEROCYCLIC COMPOUNDS, MEDICAMENTS CONTAINING SAID COMPOUNDS, USE THEREOF AND PROCESSES FOR THE PREPARATION THEREOF | BOEHRINGER INGELHEIM INT (DE) | 2019-05-01 | — | — | EP | disclosed |