Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR1 | P32246 | 4/20 | 0.37 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.36 |
| ▸ | CACNA1D | Q01668 | 2/20 | 0.36 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.36 |
| ▸ | CACNA1S | Q13698 | 1/20 | 0.36 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.36 |
| ▸ | SRD5A1 | P18405 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.35 |
| ▸ | DRD2 | P14416 | 1/20 | 0.34 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | IDO1 | P14902 | 1/20 | 0.34 |
| ▸ | PROKR1 | Q8TCW9 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9810334 | 0.88 | ALDH1A1 (0.39) | CACNA1DSMN1; SMN2HPGDNPSR1DRD2 | |
| SCHEMBL9810680 | 0.86 | CYP2C9 (0.45) | LMNAMAPTALDH1A1 | |
| SCHEMBL9810677 | 0.86 | CYP2C9 (0.45) | LMNAMAPTALDH1A1 | |
| SCHEMBL9810275 | 0.85 | SPHK1 (0.40) | — | |
| SCHEMBL9810271 | 0.85 | ABCC1 (0.49) | ABCC1CACNA1DSRD5A1SMN1; SMN2HPGD | |
| SCHEMBL9810353 | 0.84 | ABCC1 (0.40) | ABCC1CACNA1DSRD5A1SMN1; SMN2HPGD | |
| SCHEMBL9810382 | 0.84 | CYP2C9 (0.42) | LMNAMAPTALDH1A1 | |
| SCHEMBL9810377 | 0.84 | CYP2C9 (0.42) | LMNAMAPTALDH1A1 | |
| SCHEMBL9810445 | 0.82 | RAB9A (0.39) | LMNA | |
| SCHEMBL9810505 | 0.82 | POLB (0.42) | ABCC1CACNA1DSMN1; SMN2HPGDNPSR1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5068389-A | TERTIARY ALCOHOLS | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1991-11-26 | — | — | US | disclosed |