Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | IDO1 | P14902 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 3/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | MIF | P14174 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9716001 | 0.83 | IDO1 (0.35) | ALDH1A1L3MBTL1IDO1TSHRUSP2 | |
| SCHEMBL9715955 | 0.83 | ASAH1 (0.38) | ALDH1A1TSHRUSP2HPGDMAPK1 | |
| SCHEMBL9715962 | 0.80 | GAA (0.39) | ALDH1A1MIFNPC1LMNARAB9A | |
| SCHEMBL9715982 | 0.77 | ALDH1A1 (0.43) | ALDH1A1L3MBTL1SMN1; SMN2TP53IDO1 | |
| SCHEMBL536696 | 0.76 | MAPK1 (0.62) | ALDH1A1L3MBTL1SMN1; SMN2IDO1TSHR | |
| SCHEMBL9716015 | 0.74 | AHR (0.33) | — | |
| SCHEMBL9715996 | 0.74 | KMO (0.54) | ALDH1A1L3MBTL1IDO1TSHRKMT2A | |
| SCHEMBL4414547 | 0.72 | HPGD (0.60) | SMN1; SMN2IDO1HPGDMAPK1 | |
| SCHEMBL536309 | 0.71 | TDP1 (0.47) | ALDH1A1TP53IDO1HPGDMIF | |
| SCHEMBL9715935 | 0.71 | IDO1 (0.61) | IDO1 |
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-5102898-A | Halosubstituted alkyne group; fungicides | ROHM AND HAAS COMPANY (US) | 1992-04-07 | — | — | US | disclosed |