Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 4/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 3/20 | 0.46 |
| ▸ | RAB9A | P51151 | 3/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | THRA | P10827 | 2/20 | 0.45 |
| ▸ | THRB | P10828 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | PLK1 | P53350 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.44 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL8083195 | 0.83 | HPGD (0.51) | HPGDPOLBSPHK1NPC1RAB9A | |
| SCHEMBL7936552 | 0.82 | HPGD (0.50) | HPGDPOLBSPHK1NPC1RAB9A | |
| SCHEMBL5256835 | 0.80 | SPHK1 (0.46) | HPGDPOLBSPHK1NPC1RAB9A | |
| SCHEMBL31497267 | 0.79 | THRA (0.53) | HPGDPOLBSPHK1NPC1RAB9A | |
| SCHEMBL2098521 | 0.79 | HPGD (0.51) | HPGDPOLBNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL14127779 | 0.79 | HPGD (0.58) | HPGDPOLBNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL48879 | 0.79 | HPGD (0.58) | HPGDPOLBNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL21523329 | 0.78 | SPHK1 (0.54) | HPGDPOLBSPHK1ALDH1A1THRA | |
| SCHEMBL13093947 | 0.78 | SPHK1 (0.54) | HPGDPOLBSPHK1ALDH1A1THRA | |
| SCHEMBL28681651 | 0.78 | SPHK1 (0.54) | HPGDPOLBSPHK1ALDH1A1THRA |
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 |
|---|---|---|---|---|---|---|---|
| CN-104892466-B | A kind of synthesis of aniline sulphonyl class compound and its application as inhibition of HIV inhibitor | 中国科学技术大学 | 2018-05-29 | — | — | CN | disclosed |