Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 1/20 | 0.38 |
| ▸ | PDK2 | Q15119 | 3/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.33 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | GLA | P06280 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | CASP1 | P29466 | 1/20 | 0.30 |
| ▸ | CASP7 | P55210 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9545525 | 0.86 | PDK2 (0.32) | PDK2KMT2ACYP1A2CYP2C19 | |
| SCHEMBL9198100 | 0.71 | NFKB1 (0.46) | PDK2KMT2ACYP1A2CYP2C19ALDH1A1 | |
| SCHEMBL9198107 | 0.71 | NFKB1 (0.46) | PDK2KMT2ACYP1A2CYP2C19ALDH1A1 | |
| SCHEMBL9545522 | 0.68 | — | — | |
| SCHEMBL9545130 | 0.67 | CYP19A1 (0.37) | PDK2KMT2ACYP1A2CYP2C19ALDH1A1 | |
| SCHEMBL9545138 | 0.67 | CYP19A1 (0.37) | PDK2KMT2ACYP1A2CYP2C19ALDH1A1 | |
| SCHEMBL19009214 | 0.65 | PDK2 (0.42) | PDK2KMT2ACYP1A2CYP2C19ALDH1A1 | |
| SCHEMBL5951384 | 0.64 | ALDH1A1 (0.43) | GSK3BKMT2ACYP1A2ALDH1A1MAPT | |
| SCHEMBL9194471 | 0.64 | GSK3B (0.47) | GSK3BPDK2KMT2ACYP1A2CYP2C19 | |
| SCHEMBL30658986 | 0.64 | PDK2 (0.44) | PDK2KMT2ACYP1A2CYP2C19ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1993021185-A1 | SUBSTITUTED NITROGEN CONTAINING SPIRO COMPOUNDS FOR USE IN TREATING COGNITIVE DEFICITS | THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) | 1993-10-28 | — | — | WO | disclosed |