Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | CDC25B | P30305 | 3/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.43 |
| ▸ | CLEC4M | Q9H2X3 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | GABRP | O00591 | 2/20 | 0.40 |
| ▸ | GABRD | O14764 | 2/20 | 0.40 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.40 |
| ▸ | GABRB1 | P18505 | 2/20 | 0.40 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.40 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.40 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.40 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.40 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.40 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.40 |
| ▸ | GABRA4 | P48169 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL10642399 | 0.82 | FBP1 (0.45) | ALDH1A1KDM4ECLEC4MKMT2AMEN1 | |
| SCHEMBL10642534 | 0.82 | GABRP (0.58) | ALDH1A1KDM4EKMT2AMEN1NPC1 | |
| Hydrochloric Acid SCHEMBL10641678 | 0.81 | GABRP (0.57) | ALDH1A1KDM4EKMT2AMEN1NPC1 | |
| SCHEMBL10642955 | 0.78 | ALDH1A1 (0.48) | ALDH1A1KDM4EKMT2AMEN1NPC1 | |
| SCHEMBL10644635 | 0.72 | KDM4E (0.58) | ALDH1A1HSD17B10KDM4EKMT2AMEN1 | |
| SCHEMBL1653154 | 0.72 | ALDH1A1 (0.49) | ALDH1A1HSD17B10CDC25BKDM4EKMT2A | |
| SCHEMBL10642644 | 0.70 | KDM5A (0.55) | ALDH1A1CDC25BKDM4ECLEC4MKMT2A | |
| SCHEMBL7381589 | 0.70 | LMNA (0.49) | ALDH1A1KDM4EKMT2AMEN1GABRP | |
| SCHEMBL5752552 | 0.70 | CDC25B (0.70) | ALDH1A1HSD17B10CDC25BKDM4ECLEC4M | |
| Hydrochloric Acid SCHEMBL6979494 | 0.69 | CDC25B (0.71) | ALDH1A1HSD17B10CDC25BKDM4ECLEC4M |
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-4731358-A | β-carbolines and their use as tranquilizers | SCHERING AKTIENGESELLSCHAFT (DE) | 1988-03-15 | — | — | US | disclosed |