Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 1.00 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.62 |
| ▸ | IDO1 | P14902 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | DRD4 | P21917 | 6/20 | 0.42 |
| ▸ | TDO2 | P48775 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | DRD2 | P14416 | 3/20 | 0.40 |
| ▸ | DRD3 | P35462 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL18215413 | 0.85 | CYP1A2 (0.74) | CYP1A2HSD17B10DRD4DRD2DRD3 | |
| SCHEMBL18215471 | 0.85 | CYP1A2 (0.74) | CYP1A2HSD17B10DRD4DRD2DRD3 | |
| SCHEMBL2643532 | 0.85 | CYP1A2 (0.74) | CYP1A2HSD17B10DRD4DRD2DRD3 | |
| SCHEMBL11362107 | 0.81 | CYP1A2 (0.68) | CYP1A2HSD17B10TSHRALDH1A1KDM4E | |
| SCHEMBL11366929 | 0.81 | CYP1A2 (0.68) | CYP1A2HSD17B10TSHRALDH1A1KDM4E | |
| SCHEMBL11366410 | 0.81 | CYP1A2 (0.68) | CYP1A2HSD17B10TSHRALDH1A1KDM4E | |
| SCHEMBL13995842 | 0.80 | HSD17B10 (0.71) | CYP1A2HSD17B10TSHRDRD4DRD2 | |
| SCHEMBL11367617 | 0.80 | CYP1A2 (0.66) | CYP1A2HSD17B10TSHRALDH1A1KDM4E | |
| SCHEMBL11363644 | 0.80 | CYP1A2 (0.66) | CYP1A2HSD17B10IDO1TSHRALDH1A1 | |
| SCHEMBL28859675 | 0.79 | CYP1A2 (0.64) | CYP1A2HSD17B10IDO1TSHRALDH1A1 |
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-0375451-A2 | Compounds having a renin-inhibiting activity | BEECHAM GROUP PLC (GB) | 1990-06-27 | — | — | EP | disclosed |
| EP-0350163-A2 | Renin inhibitory peptides | BEECHAM GROUP PLC (GB) | 1990-01-10 | — | — | EP | disclosed |
| US-4244966-A | 1,3-Dihydro-3-(2-hydroxy-, 2-bromo- or 2-chloroethyl)-2H-isoindol-1-one derivatives | AMERICAN HOME PRODUCTS CORPORATION (US) | 1981-01-13 | — | — | US | disclosed |