Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | ERN1 | O75460 | 1/20 | 0.36 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.36 |
| ▸ | F7 | P08709 | 1/20 | 0.35 |
| ▸ | F3 | P13726 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | BCKDK | O14874 | 1/20 | 0.34 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.34 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.34 |
| ▸ | FABP3 | P05413 | 1/20 | 0.34 |
| ▸ | FABP4 | P15090 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | CASP1 | P29466 | 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 | |
|---|---|---|---|---|
| SCHEMBL28084656 | 0.93 | KMT2A (0.36) | KMT2AERN1ABCB11F7F3 | |
| SCHEMBL28084655 | 0.78 | ERN1 (0.36) | KMT2AERN1TDP1ALDH1A1KDM4E | |
| SCHEMBL28175642 | 0.78 | ERN1 (0.45) | KMT2AERN1MCL1RXFP1ALDH1A1 | |
| SCHEMBL27661280 | 0.75 | ALDH1A1 (0.61) | KMT2ATDP1ALDH1A1KDM4EMEN1 | |
| SCHEMBL28337702 | 0.74 | TERT (0.39) | KMT2AALDH1A1KDM4EMEN1HPGD | |
| SCHEMBL5427708 | 0.73 | ALDH1A1 (0.44) | KMT2ATDP1ALDH1A1KDM4EMEN1 | |
| SCHEMBL27810256 | 0.73 | ALDH1A1 (0.59) | KMT2AERN1TDP1ALDH1A1KDM4E | |
| SCHEMBL11152327 | 0.73 | TDP1 (0.43) | KMT2ATDP1ALDH1A1KDM4EMEN1 | |
| SCHEMBL27304277 | 0.73 | ALDH1A1 (0.53) | KMT2ATDP1ALDH1A1KDM4EMEN1 | |
| SCHEMBL28767893 | 0.73 | PLAU (0.39) | KMT2ATDP1ALDH1A1KDM4EMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105837478-B | As P2X3And P2X2/3The double 9 oxime derivates of double sulfonyl amerantrones of receptor antagonist | 成都理工大学 | 2017-11-14 | — | — | CN | disclosed |
| CN-105837478-A | Bisulfonyl anthracenedione dioxime derivative serving as P2X<3> and P2X<2/3> receptor antagonists | 成都理工大学 | 2016-08-10 | — | — | CN | disclosed |