Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 3/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.55 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.55 |
| ▸ | ESR1 | P03372 | 1/20 | 0.55 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.55 |
| ▸ | TSHR | P16473 | 1/20 | 0.55 |
| ▸ | PDE4A | P27815 | 1/20 | 0.55 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.55 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.55 |
| ▸ | STAT6 | P42226 | 1/20 | 0.55 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.55 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.55 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.55 |
| ▸ | ACACB | O00763 | 3/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL24747419 | 1.00 | LMNA (0.55) | LMNACYP3A4CYP2C9KDM4EABCB11 | |
| SCHEMBL24747421 | 0.94 | LMNA (0.57) | LMNACYP3A4CYP2C9KDM4EABCB11 | |
| SCHEMBL3234922 | 0.89 | NQO1 (0.61) | LMNAALDH1A1KMT2AMEN1CYP1A2 | |
| SCHEMBL24747284 | 0.87 | LMNA (0.62) | LMNACYP3A4CYP2C9KDM4EABCB11 | |
| SCHEMBL19334574 | 0.84 | LTA4H (0.60) | LMNAACACBALDH1A1KMT2AMEN1 | |
| SCHEMBL2490798 | 0.83 | NQO1 (0.70) | KDM4EADRA2ATSHRACACBALDH1A1 | |
| SCHEMBL22035223 | 0.80 | LMNA (0.55) | LMNACYP3A4CYP2C9KDM4EABCB11 | |
| SCHEMBL24747286 | 0.80 | LMNA (0.64) | LMNACYP3A4CYP2C9KDM4EABCB11 | |
| SCHEMBL24747565 | 0.80 | LMNA (0.55) | LMNACYP3A4CYP2C9KDM4EABCB11 | |
| SCHEMBL11037825 | 0.79 | ALDH1A1 (0.57) | LMNAKDM4EADRA2AALDH1A1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022233919-A2 | SPIN ON METAL-ORGANIC FORMULATIONS | MERCK PATENT GMBH (DE) | 2022-11-10 | — | — | WO | disclosed |