Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.63 |
| ▸ | ALOX12 | P18054 | 6/20 | 0.63 |
| ▸ | MEN1 | O00255 | 4/20 | 0.62 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.62 |
| ▸ | POLB | P06746 | 3/20 | 0.62 |
| ▸ | MAPT | P10636 | 4/20 | 0.61 |
| ▸ | NPC1 | O15118 | 3/20 | 0.57 |
| ▸ | RAB9A | P51151 | 3/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.57 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.56 |
| ▸ | HPGD | P15428 | 1/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.55 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.55 |
| ▸ | ACHE | P22303 | 1/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL14859863 | 0.89 | ALDH1A1 (0.59) | ALDH1A1ALOX12MEN1KMT2APOLB | |
| SCHEMBL12069264 | 0.87 | POLB (0.78) | ALDH1A1ALOX12MEN1KMT2APOLB | |
| SCHEMBL12069271 | 0.83 | ALDH1A1 (0.81) | ALDH1A1ALOX12MEN1KMT2APOLB | |
| SCHEMBL14859851 | 0.81 | POLB (0.71) | ALDH1A1ALOX12MEN1KMT2APOLB | |
| SCHEMBL14859533 | 0.80 | SCN5A (0.70) | ALDH1A1ALOX12MEN1KMT2APOLB | |
| SCHEMBL28699553 | 0.78 | RAB9A (0.83) | POLBMAPTNPC1RAB9ALMNA | |
| SCHEMBL15434970 | 0.78 | ALDH1A1 (1.00) | ALDH1A1ALOX12MEN1KMT2APOLB | |
| SCHEMBL12069911 | 0.78 | ALDH1A1 (0.66) | ALDH1A1ALOX12MEN1KMT2APOLB | |
| SCHEMBL7686270 | 0.77 | MAPT (0.77) | ALDH1A1ALOX12MEN1KMT2APOLB | |
| SCHEMBL18773973 | 0.76 | NPC1 (0.86) | MEN1KMT2APOLBMAPTNPC1 |
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 |