Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 9/20 | 0.58 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.45 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.42 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.41 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.41 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.41 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL7845062 | 0.79 | OPRK1 (0.47) | BACE1CHRM2CHRM3KDM4EALDH1A1 | |
| SCHEMBL7842018 | 0.78 | FNTA (0.54) | — | |
| SCHEMBL1171152 | 0.74 | BACE1 (1.00) | BACE1 | |
| SCHEMBL7839993 | 0.73 | CHRM2 (0.47) | BACE1CHRM2CHRM3KDM4EALDH1A1 | |
| SCHEMBL7841441 | 0.73 | MCHR1 (0.59) | BACE1CHRM2CHRM3KDM4EALDH1A1 | |
| SCHEMBL7703855 | 0.69 | MCHR1 (0.47) | BACE1CHRM2CHRM3KDM4EALDH1A1 | |
| SCHEMBL7835202 | 0.68 | SIGMAR1 (0.50) | BACE1CHRM2CHRM3KDM4EALDH1A1 | |
| SCHEMBL4832242 | 0.67 | CHRM2 (0.56) | BACE1CHRM2CHRM3KDM4EALDH1A1 | |
| SCHEMBL3894897 | 0.67 | OPRL1 (0.73) | CHRM2CHRM3KDM4EALDH1A1SIGMAR1 | |
| SCHEMBL6858091 | 0.66 | ALDH1A1 (0.76) | KDM4EALDH1A1MAPTLMNA |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1087770-A4 | INHIBITORS OF PRENYL-PROTEIN TRANSFERASE | MERCK & CO INC (US) | 2001-11-14 | — | — | EP | disclosed |
| EP-1087770-A1 | INHIBITORS OF PRENYL-PROTEIN TRANSFERASE | Merck & Co., Inc. (US) | 2001-04-04 | — | — | EP | disclosed |
| US-6172076-B1 | HETEROCYCLE-SUBSTITUTED 1,3,8-TRIAZASPIRO(4,5)DECANE DERIVATIVES; TREATING ARTERIOSCLEROSIS | MERCK & CO., INC. | 2001-01-09 | — | — | US | disclosed |
| WO-1999065494-A1 | INHIBITORS OF PRENYL-PROTEIN TRANSFERASE | MERCK & CO., INC. (US) | 1999-12-23 | — | — | WO | disclosed |