Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 6/20 | 0.39 |
| ▸ | MAPT | P10636 | 5/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.36 |
| ▸ | MAOA | P21397 | 4/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL570891 | 0.91 | MAOB (0.40) | MAOBMAPTCA1CA2CYP1B1 | |
| SCHEMBL15961267 | 0.84 | MAPT (0.39) | MAOBMAPTCYP1B1MAOARAB9A | |
| SCHEMBL570957 | 0.80 | MAPT (0.46) | MAOBMAPTCYP1B1MAOARAB9A | |
| SCHEMBL15166658 | 0.76 | GPR35 (0.41) | MAOBMAPTCA1CA2CYP1B1 | |
| SCHEMBL571130 | 0.76 | GPR35 (0.41) | MAOBMAPTCA1CA2CYP1B1 | |
| SCHEMBL570599 | 0.74 | MAOB (0.44) | MAOBMAPTCA1CA2MAOA | |
| SCHEMBL15166677 | 0.74 | MAOB (0.44) | MAOBMAPTCA1CA2MAOA | |
| SCHEMBL570888 | 0.74 | MAOB (0.39) | MAOBMAPTCA1CA2CYP1B1 | |
| SCHEMBL570890 | 0.74 | MAOB (0.39) | MAOBMAPTCA1CA2CYP1B1 | |
| SCHEMBL570975 | 0.73 | MAOB (0.39) | MAOBMAPTCA1CA2CYP1B1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2601183-A1 | COUMARIN-CHALCONES AS ANTICANCER AGENTS | Council Of Scientific & Industrial Research (IN) | 2013-06-12 | — | — | EP | disclosed |
| WO-2012017454-A1 | COUMARIN-CHALCONES AS ANTICANCER AGENTS | COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) | 2012-02-09 | — | — | WO | disclosed |