Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABL1 | P00519 | 4/20 | 0.45 |
| ▸ | ABCB1 | P08183 | 4/20 | 0.45 |
| ▸ | BCR | P11274 | 4/20 | 0.45 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.44 |
| ▸ | NQO2 | P16083 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | APP | P05067 | 2/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL415915 | 0.87 | TDP1 (0.55) | ABL1ABCB1BCRTDP1MAPK1 | |
| SCHEMBL29756035 | 0.78 | TDP1 (0.46) | TDP1CYP3A4ALDH1A1SMN1; SMN2APP | |
| SCHEMBL18889618 | 0.78 | TDP1 (0.46) | TDP1CYP3A4ALDH1A1SMN1; SMN2APP | |
| SCHEMBL3468830 | 0.78 | ACHE (0.50) | TDP1CYP3A4ALDH1A1SMN1; SMN2HSD17B10 | |
| SCHEMBL24560 | 0.75 | TDP1 (0.46) | TDP1MAPK1CYP3A4ALDH1A1SMN1; SMN2 | |
| SCHEMBL6011385 | 0.74 | ABL1 (0.47) | ABL1ABCB1BCRCYP19A1NQO2 | |
| SCHEMBL6572399 | 0.74 | ABL1 (0.47) | ABL1ABCB1BCRCYP19A1NQO2 | |
| SCHEMBL3789140 | 0.74 | TDP1 (0.56) | ABL1ABCB1BCRTDP1MAPK1 | |
| SCHEMBL3794745 | 0.74 | TDP1 (0.56) | TDP1MAPK1CYP3A4ALDH1A1SMN1; SMN2 | |
| SCHEMBL9330647 | 0.72 | TDP1 (0.48) | TDP1CYP3A4ALDH1A1SMN1; SMN2APP |
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 |
|---|---|---|---|---|---|---|---|
| CN-102557930-B | Biphenyl molecular glass and preparation method thereof | UNIV NANJING AERONAUTICS | 2014-01-29 | — | — | CN | disclosed |