Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.34 |
| ▸ | MAPT | P10636 | 4/20 | 0.34 |
| ▸ | LMNA | P02545 | 3/20 | 0.34 |
| ▸ | XBP1 | P17861 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.33 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 4/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.32 |
| ▸ | CES1 | P23141 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9316282 | 0.65 | ALDH1A1 (0.35) | SMN1; SMN2MAPTLMNAXBP1ATM | |
| SCHEMBL11495283 | 0.63 | CES1 (0.42) | TSHRSMN1; SMN2MAPTLMNAXBP1 | |
| Dimethylamine SCHEMBL607223 | 0.62 | MEN1 (0.58) | TSHRSMN1; SMN2MAPTLMNAXBP1 | |
| SCHEMBL7157657 | 0.62 | KMT2A (0.43) | TSHRSMN1; SMN2MAPTLMNAXBP1 | |
| Dimethylamine SCHEMBL8578211 | 0.61 | CES1 (0.42) | TSHRSMN1; SMN2MAPTLMNAXBP1 | |
| SCHEMBL4953900 | 0.61 | MAOA (0.44) | TSHRSMN1; SMN2MAPTLMNAXBP1 | |
| Dimethylamine SCHEMBL8980060 | 0.60 | TSHR (0.46) | TSHRSMN1; SMN2MAPTLMNAXBP1 | |
| SCHEMBL20630554 | 0.59 | LMNA (0.42) | SMN1; SMN2MAPTLMNAATMNPSR1 | |
| SCHEMBL21895900 | 0.59 | LMNA (0.42) | SMN1; SMN2MAPTLMNAATMNPSR1 | |
| Benzoic Acid SCHEMBL7547480 | 0.59 | TSHR (0.70) | TSHRSMN1; SMN2MAPTHPGDALDH1A1 |
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-3636807-A1 | CYCLIC PEPTIDE COMPOUND HAVING HIGH MEMBRANE PERMEABILITY, AND LIBRARY CONTAINING SAME | Chugai Seiyaku Kabushiki Kaisha (JP) | 2020-04-15 | — | — | EP | disclosed |