Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 1/20 | 0.53 |
| ▸ | DPP4 | P27487 | 6/20 | 0.46 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.46 |
| ▸ | DRD1 | P21728 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | TOP2A | P11388 | 3/20 | 0.45 |
| ▸ | TOP2B | Q02880 | 3/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | HPGD | P15428 | 3/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.43 |
| ▸ | STAT3 | P40763 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL5422476 | 0.89 | ADRB2 (0.51) | ADRB2DPP4CHRM2DRD1KMT2A | |
| SCHEMBL10412649 | 0.87 | ADRB2 (0.49) | ADRB2DPP4CHRM2DRD1KMT2A | |
| SCHEMBL10472546 | 0.87 | ADRB2 (0.49) | ADRB2DPP4CHRM2DRD1KMT2A | |
| SCHEMBL8942057 | 0.86 | ADRB2 (0.49) | ADRB2DPP4CHRM2DRD1KMT2A | |
| SCHEMBL7230077 | 0.85 | ADRB2 (0.50) | ADRB2DPP4CHRM2DRD1KMT2A | |
| SCHEMBL10413485 | 0.85 | ADRB2 (0.50) | ADRB2DPP4CHRM2DRD1KMT2A | |
| SCHEMBL10653563 | 0.85 | KMT2A (0.54) | ADRB2DPP4CHRM2DRD1KMT2A | |
| SCHEMBL9757281 | 0.84 | DPP4 (0.51) | ADRB2DPP4CHRM2DRD1KMT2A | |
| SCHEMBL10471652 | 0.83 | ADRB2 (0.49) | ADRB2DPP4CHRM2DRD1KMT2A | |
| SCHEMBL7005472 | 0.83 | ADRB2 (0.49) | ADRB2DPP4CHRM2DRD1KMT2A |
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-1652839-A2 | Drug efflux pump inhibitor | DAIICHI PHARMACEUTICAL CO., LTD. (JP) | 2006-05-03 | — | — | EP | disclosed |
| EP-1227084-B1 | DRUG DISCHARGE PUMP INHIBITORS | TRINE PHARMACEUTICALS INC (US) | 2005-12-14 | — | — | EP | disclosed |
| EP-1227084-A1 | DRUG DISCHARGE PUMP INHIBITORS | Microcide Pharmaceuticals, Inc. (US) | 2002-07-31 | — | — | EP | disclosed |