Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SSTR5 | P35346 | 1/20 | 0.52 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.52 |
| ▸ | GPR119 | Q8TDV5 | 7/20 | 0.43 |
| ▸ | CNR1 | P21554 | 1/20 | 0.43 |
| ▸ | CNR2 | P34972 | 1/20 | 0.43 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.42 |
| ▸ | MGLL | Q99685 | 2/20 | 0.41 |
| ▸ | KDM1A | O60341 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | IDO1 | P14902 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6824794 | 0.90 | GPR119 (0.49) | SSTR5KCNH2GPR119IDO1 | |
| SCHEMBL7658016 | 0.81 | CNR1 (0.44) | GPR119CNR1CNR2MGLLHDAC1 | |
| SCHEMBL2773743 | 0.78 | CNR1 (0.43) | GPR119CNR1CNR2KDM1AHDAC1 | |
| SCHEMBL6823297 | 0.78 | DDB1 (0.39) | GPR119KMT2AIDO1 | |
| SCHEMBL18422018 | 0.76 | MGLL (0.47) | GPR119CNR1CNR2MGLLKDM1A | |
| SCHEMBL4773466 | 0.74 | TP53 (0.54) | GPR119MEN1KMT2ATP53 | |
| SCHEMBL5672765 | 0.73 | KDM1A (0.48) | SSTR5GPR119CNR1CNR2KDM1A | |
| SCHEMBL4634695 | 0.73 | HDAC2 (0.48) | CNR1CNR2KDM1AHDAC1HDAC2 | |
| SCHEMBL14357682 | 0.73 | KDM1A (0.48) | CNR1CNR2KDM1AHDAC1HDAC2 | |
| SCHEMBL1690860 | 0.73 | IDO1 (0.47) | GPR119CNR1CNR2HDAC1HDAC2 |
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 |