Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | HTR1D | P28221 | 1/20 | 0.36 |
| ▸ | RXRB | P28702 | 4/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | KIF11 | P52732 | 2/20 | 0.35 |
| ▸ | RXRA | P19793 | 3/20 | 0.33 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.33 |
| ▸ | CASP1 | P29466 | 1/20 | 0.33 |
| ▸ | CNR1 | P21554 | 1/20 | 0.33 |
| ▸ | CNR2 | P34972 | 1/20 | 0.33 |
| ▸ | GFER | P55789 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL3220412 | 0.86 | POLB (0.45) | ALDH1A1CYP3A4TDP1TSHRPOLB | |
| SCHEMBL5715974 | 0.81 | NPC1 (0.47) | ALDH1A1CYP3A4TDP1NPC1RAB9A | |
| SCHEMBL21531579 | 0.81 | POLB (0.50) | ALDH1A1CYP3A4TDP1TSHRPOLB | |
| SCHEMBL3205589 | 0.79 | POLB (0.41) | ALDH1A1POLBNPC1RAB9AMAPT | |
| SCHEMBL21118269 | 0.74 | POLB (0.47) | ALDH1A1CYP3A4TDP1POLBNPC1 | |
| SCHEMBL24913686 | 0.73 | RXRB (0.55) | ALDH1A1CYP3A4TDP1POLBNPC1 | |
| SCHEMBL22517368 | 0.73 | ALDH1A1 (0.47) | ALDH1A1CYP3A4TDP1TSHRNPC1 | |
| SCHEMBL22554795 | 0.73 | ALDH1A1 (0.47) | ALDH1A1CYP3A4TDP1TSHRNPC1 | |
| SCHEMBL30683153 | 0.73 | ALDH1A1 (0.47) | ALDH1A1CYP3A4TDP1TSHRNPC1 | |
| SCHEMBL11090339 | 0.72 | CYP3A4 (0.55) | ALDH1A1CYP3A4TDP1TSHRNPC1 |
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 |
|---|---|---|---|---|---|---|---|
| US-20100066237-A1 | POLYMER COMPOUND AND POLYMER LIGHT EMITTING DEVICE USING THE SAME | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2010-03-18 | — | — | US | disclosed |