Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 5/20 | 0.49 |
| ▸ | MAOB | P27338 | 5/20 | 0.49 |
| ▸ | HTR2A | P28223 | 1/20 | 0.47 |
| ▸ | HTR2C | P28335 | 1/20 | 0.47 |
| ▸ | HTR2B | P41595 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.45 |
| ▸ | TUBB | P07437 | 1/20 | 0.45 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.45 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL3688202 | 1.00 | MAOA (0.49) | MAOAMAOBHTR2AHTR2CHTR2B | |
| SCHEMBL3686100 | 0.86 | MAOA (0.45) | MAOAMAOBALDH1A1HPGDMAPT | |
| SCHEMBL3692967 | 0.86 | MAOA (0.45) | MAOAMAOBALDH1A1HPGDMAPT | |
| SCHEMBL3684640 | 0.84 | MAPT (0.59) | MAOBALDH1A1HPGDMAPTMEN1 | |
| SCHEMBL3682132 | 0.84 | MAPT (0.59) | MAOBALDH1A1HPGDMAPTMEN1 | |
| SCHEMBL3684230 | 0.82 | CXCL12 (0.49) | MAOAMAOBALDH1A1MAPTMEN1 | |
| SCHEMBL3686114 | 0.82 | MEN1 (0.57) | MAOAMAOBALDH1A1HPGDMAPT | |
| SCHEMBL30383292 | 0.81 | BCHE (0.62) | MAOAMAOBALDH1A1MAPTMEN1 | |
| SCHEMBL3682133 | 0.81 | BCHE (0.62) | MAOAMAOBALDH1A1MAPTMEN1 | |
| SCHEMBL28483725 | 0.80 | MAOB (0.65) | MAOAMAOBALDH1A1HPGDMAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-7642367-B2 | Diamino-functional chalcones | LICA PHARMACEUTICALS A/S (DK) | 2010-01-05 | — | — | US | disclosed |
| US-20060235073-A1 | Diamino-functional chalcones | LICA PHARMACEUTICALS A/S (DK) | 2006-10-19 | — | — | US | disclosed |