Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | MEN1 | O00255 | 4/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | ADORA3 | P0DMS8 | 4/20 | 0.40 |
| ▸ | ADORA1 | P30542 | 4/20 | 0.40 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.40 |
| ▸ | HPGD | P15428 | 4/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.39 |
| ▸ | RELA | Q04206 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8901022 | 0.94 | ADORA3 (0.44) | ALDH1A1MEN1KMT2ASMN1; SMN2NPC1 | |
| Trifluoroacetic Acid SCHEMBL8894608 | 0.92 | ADORA3 (0.40) | ALDH1A1MEN1KMT2ASMN1; SMN2NPC1 | |
| Trifluoroacetic Acid SCHEMBL8891099 | 0.91 | ADORA3 (0.41) | ALDH1A1MEN1KMT2ASMN1; SMN2RAB9A | |
| Trifluoroacetic Acid SCHEMBL8902577 | 0.88 | KEAP1 (0.42) | ALDH1A1MEN1KMT2ASMN1; SMN2NPC1 | |
| SCHEMBL8901213 | 0.87 | ALDH1A1 (0.38) | ALDH1A1MEN1KMT2ASMN1; SMN2NPC1 | |
| SCHEMBL8891085 | 0.86 | TLR8 (0.41) | ADORA3ADORA1ADORA2AMAPTNEU3 | |
| Trifluoroacetic Acid SCHEMBL8892900 | 0.86 | ADORA2A (0.43) | ALDH1A1MEN1KMT2AGAATDP1 | |
| SCHEMBL8891817 | 0.85 | ADORA3 (0.44) | ALDH1A1MEN1KMT2ASMN1; SMN2NPC1 | |
| SCHEMBL8891755 | 0.85 | PTGFR (0.41) | ALDH1A1MEN1KMT2ASMN1; SMN2NPC1 | |
| SCHEMBL8891736 | 0.85 | ADORA3 (0.46) | ALDH1A1MEN1KMT2ASMN1; SMN2NPC1 |
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-1997033872-A1 | ANTI-VIRAL 4-ACYLAMINO-3-[IMIDAZOL-I-YL]-BENZOIC ACID DERIVATIVES | BIOTA SCIENTIFIC MANAGEMENT PTY. LTD. (AU) | 1997-09-18 | — | — | WO | disclosed |