Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | MMP1 | P03956 | 1/20 | 0.35 |
| ▸ | MMP2 | P08253 | 1/20 | 0.35 |
| ▸ | MMP3 | P08254 | 1/20 | 0.35 |
| ▸ | MMP9 | P14780 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL19225769 | 0.88 | KMT2A (0.42) | KMT2AMEN1L3MBTL1TDP1ALDH1A1 | |
| SCHEMBL19841774 | 0.84 | KMT2A (0.35) | KMT2AMEN1L3MBTL1TDP1ALDH1A1 | |
| SCHEMBL18427198 | 0.83 | L3MBTL1 (0.46) | KMT2AMEN1L3MBTL1TDP1ALDH1A1 | |
| SCHEMBL25095583 | 0.83 | HTT (0.46) | KMT2AMEN1TDP1CYP1A2HPGD | |
| SCHEMBL3125351 | 0.83 | RIPK1 (0.53) | KMT2AMEN1L3MBTL1TDP1ALDH1A1 | |
| SCHEMBL13713511 | 0.82 | MEN1 (0.48) | KMT2AMEN1L3MBTL1ALDH1A1 | |
| SCHEMBL19412557 | 0.81 | L3MBTL1 (0.33) | KMT2AMEN1L3MBTL1TDP1ALDH1A1 | |
| SCHEMBL13178621 | 0.81 | CA2 (0.44) | RIPK1HPGD | |
| SCHEMBL8488503 | 0.81 | KMT2A (0.41) | KMT2AMEN1L3MBTL1TDP1ALDH1A1 | |
| SCHEMBL8488509 | 0.81 | KMT2A (0.41) | KMT2AMEN1L3MBTL1TDP1ALDH1A1 |
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-2020219417-A1 | GALACTOSE-LINKED MULTIMERIC GLYCOMIMETIC INHIBITORS OF E-SELECTINS, GALECTIN-3, AND/OR CXCR4 CHEMOKINE RECEPTORS | GLYCOMIMETICS, INC. (US) | 2020-10-29 | — | — | WO | disclosed |