Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 3/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Ethylene SCHEMBL11097350 | 0.97 | ALDH1A1 (0.44) | ALDH1A1KCNA3TP53HTTLMNA | |
| SCHEMBL2795442 | 0.88 | ALDH1A1 (0.51) | ALDH1A1TP53HTTLMNAGAA | |
| SCHEMBL2987151 | 0.84 | ALDH1A1 (0.49) | ALDH1A1TP53HTTLMNAGAA | |
| SCHEMBL2978592 | 0.84 | AKR1C1 (0.53) | ALDH1A1TP53HTTLMNAGAA | |
| SCHEMBL17761271 | 0.83 | AKR1C1 (0.52) | ALDH1A1TP53HTTLMNAGAA | |
| SCHEMBL3218594 | 0.83 | AKR1C1 (0.52) | ALDH1A1TP53HTTLMNAGAA | |
| SCHEMBL2983992 | 0.80 | ALDH1A1 (0.68) | ALDH1A1TP53HTTLMNAGAA | |
| Hydrochloric Acid SCHEMBL8353127 | 0.79 | ALDH1A1 (0.45) | ALDH1A1TP53HTTLMNAGAA | |
| SCHEMBL20887803 | 0.77 | OPRM1 (0.49) | ALDH1A1KCNA3LMNATSHRHCAR2 | |
| SCHEMBL2986864 | 0.77 | ALDH1A1 (0.46) | ALDH1A1TP53HTTLMNAGAA |
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-4460604-A | ANALGESICS, NARCOTIC ANTAGONIST | THE UPJOHN COMPANY (US) | 1984-07-17 | — | — | US | disclosed |
| US-4180584-A | ANALGESIC; NARCOTIC ANTAGONIST | THE UPJOHN COMPANY (US) | 1979-12-25 | — | — | US | disclosed |
| US-4065573-A | ANALGESICS | THE UPJOHN COMPANY (US) | 1977-12-27 | — | — | US | disclosed |