Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 4/20 | 0.41 |
| ▸ | MASP2 | O00187 | 1/20 | 0.39 |
| ▸ | PLAU | P00749 | 1/20 | 0.39 |
| ▸ | THPO | P40225 | 1/20 | 0.39 |
| ▸ | APEX1 | P27695 | 2/20 | 0.38 |
| ▸ | F2 | P00734 | 1/20 | 0.38 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.38 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | MEN1 | O00255 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | ESR1 | P03372 | 2/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.36 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 3/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | MAOA | P21397 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL13271458 | 0.77 | TPMT (0.39) | MAPTMEN1KMT2AESR1LMNA | |
| SCHEMBL28085607 | 0.76 | ATM (0.38) | MAPTMEN1KMT2ACYP1B1LMNA | |
| SCHEMBL18460837 | 0.76 | ATM (0.38) | MAPTMEN1KMT2ACYP1B1LMNA | |
| SCHEMBL20627467 | 0.75 | F2 (0.46) | CYP19A1F2PRSS1PRSS3MEN1 | |
| SCHEMBL21936463 | 0.74 | APP (0.39) | MAPTNPC1RAB9ACYP3A4ALDH1A1 | |
| SCHEMBL21094943 | 0.74 | HDAC1 (0.44) | APEX1MAPTMEN1KMT2ALMNA | |
| SCHEMBL18658383 | 0.74 | HSD17B1 (0.47) | MAPTMEN1KMT2AESR1ESR2 | |
| SCHEMBL25704003 | 0.74 | ALDH1A1 (0.47) | PLAUMAPTLMNARAB9AALDH1A1 | |
| SCHEMBL16433594 | 0.74 | CYP19A1 (0.43) | CYP19A1MASP2PLAUTHPOAPEX1 | |
| SCHEMBL12825145 | 0.73 | MASP2 (0.31) | MASP2PLAUTHPOAPEX1F2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2999699-B1 | PURINE DIONES AS WNT PATHWAY MODULATORS | AGENCY SCIENCE TECH & RES (SG) | 2020-04-29 | — | — | EP | disclosed |