Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSC | P53634 | 1/20 | 0.42 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.38 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.38 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.38 |
| ▸ | CHRNA7 | P36544 | 2/20 | 0.38 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | HBB | P68871 | 1/20 | 0.38 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.38 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.37 |
| ▸ | DPP4 | P27487 | 4/20 | 0.36 |
| ▸ | DPP8 | Q6V1X1 | 4/20 | 0.36 |
| ▸ | DPP9 | Q86TI2 | 4/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7335419 | 1.00 | CTSC (0.42) | CTSCCHRNB2CHRNB4CHRNA3CHRNA7 | |
| SCHEMBL7335416 | 1.00 | CTSC (0.42) | CTSCCHRNB2CHRNB4CHRNA3CHRNA7 | |
| SCHEMBL7335426 | 1.00 | CTSC (0.42) | CTSCCHRNB2CHRNB4CHRNA3CHRNA7 | |
| SCHEMBL7335998 | 0.86 | CTSC (0.38) | CTSCMAPTHTTEPHX1DPP4 | |
| SCHEMBL7333414 | 0.86 | CTSC (0.38) | CTSCMAPTHTTEPHX1DPP4 | |
| SCHEMBL6567240 | 0.85 | MAPT (0.45) | CHRNB2CHRNB4CHRNA3CHRNA7CHRNA4 | |
| Benzoic Acid SCHEMBL28112972 | 0.83 | DAO (0.47) | ALOX15 | |
| SCHEMBL10860742 | 0.81 | CYP1A2 (0.58) | ALOX15DPP4 | |
| SCHEMBL14434841 | 0.79 | CHRNA7 (0.40) | CTSCCHRNA7 | |
| SCHEMBL9028115 | 0.79 | CHRNA7 (0.40) | CTSCCHRNA7 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0677041-A1 | CHEMICAL COMPOUNDS | SMITHKLINE BEECHAM CORPORATION (US) | 1995-10-18 | — | — | EP | disclosed |
| EP-0677041-A4 | CHEMICAL COMPOUNDS. | SMITHKLINE BEECHAM CORP (US) | 1995-08-29 | — | — | EP | disclosed |
| WO-1994015913-A1 | CHEMICAL COMPOUNDS | SMITHKLINE BEECHAM CORPORATION (US) | 1994-07-21 | — | — | WO | disclosed |