Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.52 |
| ▸ | NPC1 | O15118 | 4/20 | 0.52 |
| ▸ | TP53 | P04637 | 4/20 | 0.52 |
| ▸ | RAB9A | P51151 | 3/20 | 0.52 |
| ▸ | HPGD | P15428 | 3/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.52 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.52 |
| ▸ | RELA | Q04206 | 1/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 3/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.52 |
| ▸ | GAA | P10253 | 2/20 | 0.52 |
| ▸ | MAPT | P10636 | 2/20 | 0.52 |
| ▸ | BLM | P54132 | 1/20 | 0.52 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.52 |
| ▸ | PKM | P14618 | 3/20 | 0.51 |
| ▸ | AMY1A | P0DUB6 | 5/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL31154221 | 0.84 | MEN1 (0.51) | ALDH1A1SMN1; SMN2KDM4ENPC1TP53 | |
| SCHEMBL17255179 | 0.84 | MAPT (0.46) | ALDH1A1SMN1; SMN2KDM4ENPC1TP53 | |
| SCHEMBL17393725 | 0.84 | MAOB (0.54) | ALDH1A1SMN1; SMN2KDM4ETP53HPGD | |
| SCHEMBL1170729 | 0.83 | ALDH1A1 (0.57) | ALDH1A1SMN1; SMN2KDM4ENPC1TP53 | |
| SCHEMBL7917574 | 0.82 | ALDH1A1 (0.61) | ALDH1A1SMN1; SMN2KDM4ENPC1TP53 | |
| SCHEMBL2324292 | 0.81 | NPC1 (0.78) | ALDH1A1SMN1; SMN2KDM4ENPC1TP53 | |
| SCHEMBL15454889 | 0.80 | PDE4A (0.53) | ALDH1A1SMN1; SMN2KDM4ENPC1RAB9A | |
| SCHEMBL179157 | 0.79 | NPC1 (0.63) | ALDH1A1SMN1; SMN2KDM4ENPC1TP53 | |
| SCHEMBL30108052 | 0.79 | ALDH1A1 (0.58) | ALDH1A1SMN1; SMN2KDM4ENPC1TP53 | |
| SCHEMBL31154110 | 0.79 | AMY1A (0.63) | ALDH1A1SMN1; SMN2NPC1RAB9ANFKB1 |
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-6211177-B1 | SIDE EFFECT REDUCTION | CELL PATHWAYS, INC. | 2001-04-03 | — | — | US | disclosed |