Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR3 | P46089 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | BACE1 | P56817 | 2/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | GLA | P06280 | 2/20 | 0.33 |
| ▸ | ERCC1 | P07992 | 1/20 | 0.33 |
| ▸ | FEN1 | P39748 | 1/20 | 0.33 |
| ▸ | ERCC4 | Q92889 | 1/20 | 0.33 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.33 |
| ▸ | CDK9 | P50750 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | P2RX4 | Q99571 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9654009 | 0.74 | IDO1 (0.42) | GPR3CYP2C19CYP1A2POLBKDM4E | |
| SCHEMBL28562457 | 0.73 | GPR3 (0.36) | GPR3CYP2C19CYP1A2POLBKDM4E | |
| SCHEMBL8927744 | 0.73 | MEN1 (0.46) | GPR3CYP2C19CYP1A2POLBKDM4E | |
| SCHEMBL315328 | 0.73 | GPR84 (0.55) | GPR3POLBKDM4EALDH1A1HTT | |
| SCHEMBL8186050 | 0.72 | ASH1L (0.47) | CYP2C19CYP1A2POLBKDM4EALDH1A1 | |
| SCHEMBL20674511 | 0.71 | GPR84 (0.44) | GPR3CYP2C19CYP1A2POLBKDM4E | |
| SCHEMBL887129 | 0.71 | HTT (0.54) | POLBKDM4EALDH1A1HTTGLA | |
| SCHEMBL8530588 | 0.71 | KDM4E (0.41) | POLBKDM4EALDH1A1HTTMEN1 | |
| SCHEMBL9550626 | 0.70 | CYP1A2 (0.37) | CYP1A2POLBKDM4EALDH1A1L3MBTL1 | |
| SCHEMBL8527729 | 0.70 | POLB (0.33) | GPR3POLBKDM4EALDH1A1L3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5614498-A | OLIGOPEPTIDES, BRONCHDILATORS | BANYU PHARMACEUTICAL CO., LTD. (JP) | 1997-03-25 | — | — | US | disclosed |
| US-5496928-A | Endothelin antagonistic substance | BANYU PHARMACEUTICAL CO., LTD. (JP) | 1996-03-05 | — | — | US | disclosed |
| EP-0555537-A2 | Endothelin antagonistic substance | BANYU PHARMACEUTICAL CO., LTD. (JP) | 1993-08-18 | — | — | EP | disclosed |