Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | RXRA | P19793 | 3/20 | 0.44 |
| ▸ | RXRB | P28702 | 3/20 | 0.44 |
| ▸ | RBP4 | P02753 | 3/20 | 0.43 |
| ▸ | AGBL2 | Q5U5Z8 | 1/20 | 0.43 |
| ▸ | RXRG | P48443 | 2/20 | 0.40 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.40 |
| ▸ | RIPK1 | Q13546 | 2/20 | 0.39 |
| ▸ | MMP1 | P03956 | 1/20 | 0.39 |
| ▸ | MMP2 | P08253 | 1/20 | 0.39 |
| ▸ | MMP3 | P08254 | 1/20 | 0.39 |
| ▸ | MMP9 | P14780 | 1/20 | 0.39 |
| ▸ | MMP12 | P39900 | 1/20 | 0.39 |
| ▸ | MMP13 | P45452 | 1/20 | 0.39 |
| ▸ | MMP14 | P50281 | 1/20 | 0.39 |
| ▸ | SRC | P12931 | 1/20 | 0.39 |
| ▸ | POLQ | O75417 | 1/20 | 0.39 |
| ▸ | PTGDR2 | Q9Y5Y4 | 2/20 | 0.38 |
| ▸ | CXCL8 | P10145 | 1/20 | 0.38 |
| ▸ | ANO1 | Q5XXA6 | 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 | |
|---|---|---|---|---|
| SCHEMBL892786 | 0.84 | IDO1 (0.53) | TSHRRXRARXRBRXRGPOLQ | |
| SCHEMBL4630314 | 0.81 | ALDH1A1 (0.50) | TSHRRXRARXRB | |
| SCHEMBL30885859 | 0.81 | ALDH1A1 (0.50) | TSHRRXRARXRB | |
| SCHEMBL12740308 | 0.80 | IDO1 (0.42) | RBP4RIPK1 | |
| SCHEMBL2625769 | 0.80 | IDO1 (0.42) | RBP4RIPK1 | |
| SCHEMBL28552617 | 0.79 | IDO1 (0.44) | RBP4RIPK1 | |
| SCHEMBL2395772 | 0.77 | TSHR (0.54) | TSHRAGBL2SRCCXCL8ANO1 | |
| SCHEMBL154096 | 0.77 | RXRA (0.49) | TSHRRXRARXRBAGBL2RXRG | |
| SCHEMBL20844685 | 0.77 | NR1H4 (0.44) | RXRARXRBRXRGNR1H4SRC | |
| SCHEMBL28552616 | 0.77 | IDO1 (0.45) | RBP4RIPK1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019057946-A1 | MULTI-CYCLIC AROMATIC COMPOUNDS AS FACTOR D INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2019-03-28 | — | — | WO | disclosed |