Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPY2R | P49146 | 5/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL5850848 | 0.92 | L3MBTL1 (0.36) | NPY2RALDH1A1L3MBTL1NPSR1TP53 | |
| SCHEMBL5852560 | 0.92 | CYP2C9 (0.45) | NPY2RALDH1A1L3MBTL1HPGDMEN1 | |
| SCHEMBL5850597 | 0.88 | CYP2D6 (0.36) | — | |
| SCHEMBL5850585 | 0.86 | PTGES (0.36) | ALDH1A1KMT2A | |
| SCHEMBL5850647 | 0.84 | CYP1A2 (0.43) | NPY2RALDH1A1L3MBTL1NPSR1TP53 | |
| SCHEMBL5850625 | 0.83 | PTGES (0.34) | NPY2RALDH1A1TP53 | |
| SCHEMBL5851162 | 0.82 | CYP2C9 (0.41) | NPY2RALDH1A1L3MBTL1NPSR1TP53 | |
| SCHEMBL5850810 | 0.80 | DPP4 (0.35) | ALDH1A1L3MBTL1NPSR1TP53ALOX15 | |
| SCHEMBL3850683 | 0.79 | HTR2C (0.36) | NPY2RMEN1KMT2ACYP1A2CYP2C9 | |
| SCHEMBL5850731 | 0.79 | TAS2R14 (0.38) | ALDH1A1NPSR1MEN1KMT2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7030114-B1 | Compounds which inhibit leukocyte adhesion mediated by VLA-4 | ELAN PHARMACEUTICALS, INC. (US) | 2006-04-18 | — | — | US | claimed |
| US-7030114-B1 | Compounds which inhibit leukocyte adhesion mediated by VLA-4 | ELAN PHARMACEUTICALS, INC. (US) | 2006-04-18 | — | — | US | disclosed |