Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TMEM97 | Q5BJF2 | 4/20 | 0.46 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 4/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.41 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.41 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.41 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.41 |
| ▸ | PRKCG | P05129 | 1/20 | 0.41 |
| ▸ | CDK1 | P06493 | 1/20 | 0.41 |
| ▸ | PIM1 | P11309 | 1/20 | 0.41 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.41 |
| ▸ | CDK2 | P24941 | 1/20 | 0.41 |
| ▸ | AKT1 | P31749 | 1/20 | 0.41 |
| ▸ | AKT2 | P31751 | 1/20 | 0.41 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.41 |
| ▸ | RPS6KA3 | P51812 | 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 | |
|---|---|---|---|---|
| SCHEMBL11501786 | 0.91 | LMNA (0.46) | TMEM97SIGMAR1SLC6A3TSHRLMNA | |
| SCHEMBL11668325 | 0.87 | CNR1 (0.50) | SLC6A3TSHRLMNANPC1CNR1 | |
| SCHEMBL11501627 | 0.87 | CNR1 (0.50) | SLC6A3TSHRLMNANPC1CNR1 | |
| SCHEMBL11674067 | 0.87 | CNR1 (0.50) | SLC6A3TSHRLMNANPC1CNR1 | |
| SCHEMBL11501942 | 0.79 | TP53 (0.56) | SIGMAR1POLBCNR1TP53CYP1A2 | |
| SCHEMBL11668323 | 0.74 | ALDH1A1 (0.50) | SLC6A3CNR1HTR3AMEN1KMT2A | |
| SCHEMBL11668293 | 0.73 | FPR2 (0.48) | SIGMAR1MEN1KMT2A | |
| SCHEMBL11668446 | 0.73 | HTR3E (0.68) | LMNANPC1TP53CYP3A4HTT | |
| SCHEMBL11668524 | 0.73 | HDAC1 (0.51) | LMNAHTTHTR3A | |
| SCHEMBL7505669 | 0.72 | CNR1 (0.63) | SLC6A3LMNAPOLBNPC1CNR1 |
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-4166827-A | DENTAL PLAQUE | COOPER LABORATORIES, INC. (US) | 1979-09-04 | — | — | US | claimed |