Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.58 |
| ▸ | MAPT | P10636 | 4/20 | 0.58 |
| ▸ | RAB9A | P51151 | 2/20 | 0.58 |
| ▸ | MEN1 | O00255 | 2/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.58 |
| ▸ | HTT | P42858 | 1/20 | 0.58 |
| ▸ | LMNA | P02545 | 4/20 | 0.53 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.51 |
| ▸ | SIRT1 | Q96EB6 | 8/20 | 0.50 |
| ▸ | SIRT2 | Q8IXJ6 | 6/20 | 0.50 |
| ▸ | ALOX12 | P18054 | 4/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL12069259 | 0.88 | ALDH1A1 (0.60) | ALDH1A1SMN1; SMN2MAPTRAB9AMEN1 | |
| SCHEMBL12067850 | 0.79 | ALDH1A1 (0.57) | ALDH1A1SMN1; SMN2MAPTRAB9AMEN1 | |
| SCHEMBL12067845 | 0.79 | ALDH1A1 (0.57) | ALDH1A1SMN1; SMN2MAPTRAB9AMEN1 | |
| SCHEMBL14865706 | 0.76 | ALDH1A1 (0.65) | ALDH1A1SMN1; SMN2MAPTRAB9AMEN1 | |
| SCHEMBL12067871 | 0.76 | SIRT1 (0.71) | ALDH1A1SMN1; SMN2MAPTRAB9AMEN1 | |
| SCHEMBL14859488 | 0.75 | ALDH1A1 (0.64) | ALDH1A1SMN1; SMN2MAPTRAB9AMEN1 | |
| SCHEMBL14859651 | 0.75 | ALDH1A1 (0.64) | ALDH1A1SMN1; SMN2MAPTRAB9AMEN1 | |
| SCHEMBL2344164 | 0.73 | ALDH1A1 (0.71) | ALDH1A1SMN1; SMN2MAPTRAB9AMEN1 | |
| SCHEMBL14860324 | 0.73 | ALDH1A1 (0.69) | ALDH1A1SMN1; SMN2MAPTRAB9AMEN1 | |
| SCHEMBL12068669 | 0.72 | ALDH1A1 (0.51) | ALDH1A1SMN1; SMN2MAPTRAB9AMEN1 |
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-2011159137-A2 | NOVEL THIOUREA OR UREA DERIVATIVE, PREPARATION METHOD THEREOF, AND PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING AIDS, CONTAINING SAME AS ACTIVE INGREDIENT | (주)에빅스젠 (KR) | 2011-12-22 | — | — | WO | disclosed |