Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | NR3C2 | P08235 | 8/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.35 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.35 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.35 |
| ▸ | ITGB7 | P26010 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7386587 | 0.71 | AKR1C1 (0.36) | HSD11B1ITGB1ITGA4ITGB7LMNA | |
| SCHEMBL14159710 | 0.69 | TSHR (0.43) | CYP3A4TSHRLMNACYP2D6CYP2C19 | |
| SCHEMBL14159720 | 0.69 | GAA (0.38) | CYP3A4TSHRMEN1KMT2ALMNA | |
| SCHEMBL1841591 | 0.66 | LMNA (0.46) | CYP3A4MAPTMEN1KMT2AHSD11B1 | |
| SCHEMBL7380005 | 0.65 | ITGB1 (0.39) | ITGB1ITGA4ITGB7LMNACYP2C19 | |
| SCHEMBL2391023 | 0.65 | CYP3A4 (0.41) | CYP3A4TSHRMAPTMEN1KMT2A | |
| SCHEMBL4701574 | 0.63 | MAOA (0.33) | CYP3A4TSHRMEN1KMT2ALMNA | |
| SCHEMBL576343 | 0.63 | LMNA (0.41) | LMNA | |
| SCHEMBL27989707 | 0.62 | MAOA (0.40) | CYP3A4LMNA | |
| SCHEMBL13818225 | 0.62 | LMNA (0.43) | CYP3A4KMT2AHSD11B1LMNA |
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-6420418-B1 | INHIBITION AND PREVENTION OF LEUKOCYTE ADHESION; USED TO TREAT ADHESION-MEDIATED DISEASES SUCH AS ASTHMA, ALLERGIC RHINITIS, MULTIPLE SCLEROSIS; ATHEROSCLEROSIS, AND INFLAMMATORY BOWEL DISEASE | MERCK & CO., INC. | 2002-07-16 | — | — | US | disclosed |