Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AOC2 | O75106 | 1/20 | 0.42 |
| ▸ | IP6K1 | Q92551 | 5/20 | 0.41 |
| ▸ | IP6K3 | Q96PC2 | 3/20 | 0.41 |
| ▸ | IP6K2 | Q9UHH9 | 1/20 | 0.41 |
| ▸ | PIM1 | P11309 | 2/20 | 0.36 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.33 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.33 |
| ▸ | L3MBTL3 | Q96JM7 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.33 |
| ▸ | MELK | Q14680 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | AKT2 | P31751 | 1/20 | 0.31 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.31 |
| ▸ | PLAT | P00750 | 1/20 | 0.31 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.31 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL2915396 | 0.84 | IP6K1 (0.45) | AOC2IP6K1ADRB1HRH3 | |
| SCHEMBL7655813 | 0.75 | GPR119 (0.61) | MAPTTHRBGPR119 | |
| SCHEMBL13531632 | 0.74 | IP6K1 (0.45) | AOC2IP6K1IP6K3HTTMAPT | |
| SCHEMBL13531474 | 0.73 | HRH4 (0.46) | IP6K1HTTHRH3 | |
| SCHEMBL4434104 | 0.72 | CYP1A2 (0.39) | PIM1L3MBTL3L3MBTL1MELKGPR119 | |
| Tert-Butyl Formate SCHEMBL28789864 | 0.70 | ADRB1 (0.39) | AOC2IP6K1ADRB1HRH3 | |
| SCHEMBL22796056 | 0.70 | JAK3 (0.43) | IP6K1L3MBTL1MAPT | |
| SCHEMBL3617657 | 0.69 | GPR119 (0.58) | PIM1GPR119 | |
| SCHEMBL4716642 | 0.68 | PLD1 (0.70) | MAPTGPR119 | |
| SCHEMBL3621655 | 0.68 | GPR119 (0.56) | PIM1DDB1CRBNGPR119 |
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-6498161-B1 | TREATING INFECTION BY HIV; DELAYING OF THE ONSET OF AIDS; ASTHMA, ALLERGIC RHINITIS, DERMATITIS, CONJUNCTIVITIS, ATHEROSCLEROSIS OR RHEUMATOID ARTHRITIS | MERCK & CO., INC. | 2002-12-24 | — | — | US | disclosed |
| WO-2000059498-A1 | PYRROLIDINE MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY | MERCK & CO., INC. (US) | 2000-10-12 | — | — | WO | disclosed |