Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 1/20 | 0.39 |
| ▸ | ELANE | P08246 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | BACE1 | P56817 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL2389761 | 0.73 | CYP3A4 (0.41) | CYP3A4LMNAALDH1A1GLAHPGD | |
| SCHEMBL2392660 | 0.72 | LMNA (0.45) | CYP3A4LMNAALDH1A1GLAHPGD | |
| SCHEMBL1642185 | 0.66 | ELANE (0.40) | CYP3A4LMNAALDH1A1ELANEMEN1 | |
| SCHEMBL1190993 | 0.65 | CYP3A4 (0.39) | CYP3A4LMNAALDH1A1HTR2CMEN1 | |
| SCHEMBL7744080 | 0.65 | CYP3A4 (0.38) | CYP3A4LMNAMEN1MAPTKMT2A | |
| SCHEMBL1642227 | 0.65 | ALDH1A1 (0.39) | ALDH1A1GLAHPGDHTR2CMEN1 | |
| SCHEMBL31393199 | 0.65 | GAA (0.42) | LMNAALDH1A1ELANEKMT2AHSD17B10 | |
| SCHEMBL21631826 | 0.64 | OPRM1 (0.36) | CYP3A4LMNAALDH1A1HSD11B1HSD17B10 | |
| SCHEMBL28538161 | 0.63 | ELANE (0.55) | LMNAALDH1A1ELANEMEN1KMT2A | |
| SCHEMBL3284001 | 0.63 | ELANE (0.55) | LMNAALDH1A1ELANEMEN1KMT2A |
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-8013008-B2 | Cyclic amine compound | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2011-09-06 | — | — | US | disclosed |