Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | TUBB1 | Q9H4B7 | 1/20 | 0.40 |
| ▸ | AOX1 | Q06278 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | PRKDC | P78527 | 1/20 | 0.39 |
| ▸ | FDPS | P14324 | 1/20 | 0.38 |
| ▸ | ERN1 | O75460 | 3/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
| ▸ | TLR2 | O60603 | 1/20 | 0.37 |
| ▸ | TLR1 | Q15399 | 1/20 | 0.37 |
| ▸ | TLR6 | Q9Y2C9 | 1/20 | 0.37 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.37 |
| ▸ | ALDH5A1 | P51649 | 1/20 | 0.37 |
| ▸ | ABAT | P80404 | 1/20 | 0.37 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL194592 | 0.81 | ALDH1A1 (0.46) | ALDH1A1TSHRTDP1KDM4ELMNA | |
| SCHEMBL10321078 | 0.79 | ALDH1A1 (0.44) | ALDH1A1TSHRTDP1KDM4ELMNA | |
| SCHEMBL7586055 | 0.77 | PDE4B (0.48) | ALDH1A1TSHRTDP1KDM4E | |
| SCHEMBL23802086 | 0.77 | ALDH1A1 (0.42) | ALDH1A1TSHRTDP1KDM4ELMNA | |
| SCHEMBL10320513 | 0.76 | ALDH1A1 (0.41) | ALDH1A1TSHRTDP1KDM4ELMNA | |
| SCHEMBL11185676 | 0.75 | ALDH1A1 (0.43) | ALDH1A1TSHRTDP1KDM4ELMNA | |
| SCHEMBL7586053 | 0.75 | MEN1 (0.51) | ALDH1A1TSHRTDP1KDM4ELMNA | |
| SCHEMBL20379847 | 0.75 | LMNA (0.43) | ALDH1A1TSHRTDP1KDM4ELMNA | |
| SCHEMBL23231388 | 0.75 | KDM1A (0.46) | ALDH1A1LMNATUBB1MAOASMN1; SMN2 | |
| SCHEMBL30089510 | 0.74 | KMT2A (0.47) | ALDH1A1TSHRTDP1KDM4ELMNA |
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-2022226408-A1 | NOVEL ERGOLINES AND METHODS OF TREATING MOOD DISORDERS | GILGAMESH PHARMACEUTICALS, INC. (US) | 2022-10-27 | — | — | WO | disclosed |