Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO1 | P15559 | 1/20 | 0.44 |
| ▸ | ACACB | O00763 | 1/20 | 0.39 |
| ▸ | ACACA | Q13085 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.38 |
| ▸ | ERN1 | O75460 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | XDH | P47989 | 1/20 | 0.38 |
| ▸ | RXRA | P19793 | 1/20 | 0.36 |
| ▸ | RXRB | P28702 | 1/20 | 0.36 |
| ▸ | LTA4H | P09960 | 1/20 | 0.36 |
| ▸ | MMP1 | P03956 | 1/20 | 0.36 |
| ▸ | MMP2 | P08253 | 1/20 | 0.36 |
| ▸ | MMP3 | P08254 | 1/20 | 0.36 |
| ▸ | MMP7 | P09237 | 1/20 | 0.36 |
| ▸ | MMP9 | P14780 | 1/20 | 0.36 |
| ▸ | MMP8 | P22894 | 1/20 | 0.36 |
| ▸ | MMP13 | P45452 | 1/20 | 0.36 |
| ▸ | MMP14 | P50281 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL10833646 | 0.76 | MCL1 (0.44) | ACACBACACANPC1RAB9A | |
| SCHEMBL1370233 | 0.74 | ALDH1A1 (0.36) | PTGS2RXRARXRBALDH1A1NPC1 | |
| SCHEMBL28981683 | 0.74 | NQO1 (0.61) | NQO1ERN1TSHRTDP1XDH | |
| SCHEMBL158260 | 0.74 | NQO1 (0.61) | NQO1ERN1TSHRTDP1XDH | |
| SCHEMBL18417193 | 0.73 | NQO1 (0.82) | NQO1TSHRTDP1XDHLTA4H | |
| SCHEMBL5833291 | 0.73 | NQO1 (0.82) | NQO1TSHRTDP1XDHLTA4H | |
| SCHEMBL9155582 | 0.73 | NQO1 (0.82) | NQO1TSHRTDP1XDHLTA4H | |
| SCHEMBL17046255 | 0.73 | NQO1 (0.48) | NQO1ACACBACACATSHRTDP1 | |
| SCHEMBL2692130 | 0.72 | NQO1 (0.58) | NQO1ACACBACACAPTGS2TSHR | |
| SCHEMBL13048467 | 0.71 | NQO1 (0.70) | NQO1PTGS2ERN1TSHRTDP1 |
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-102781949-B | Phosphinyl amidine compounds, metal complexes, catalyst systems, and their use for oligomerizing or polymerizing olefins | 切弗朗菲利浦化学公司 | 2016-07-06 | — | — | CN | disclosed |