Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.39 |
| ▸ | TSHR | P16473 | 4/20 | 0.39 |
| ▸ | HPGD | P15428 | 4/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.39 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.39 |
| ▸ | TYMS | P04818 | 3/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.33 |
| ▸ | ATM | Q13315 | 2/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
| ▸ | PARP1 | P09874 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | RAD52 | P43351 | 1/20 | 0.31 |
| ▸ | CES2 | O00748 | 1/20 | 0.31 |
| ▸ | BCHE | P06276 | 1/20 | 0.31 |
| ▸ | CES1 | P23141 | 1/20 | 0.31 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.31 |
| ▸ | DHFR | P00374 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7122495 | 0.76 | PDK2 (0.33) | — | |
| SCHEMBL28618972 | 0.70 | PDK2 (0.36) | CES2CES1 | |
| SCHEMBL19454302 | 0.68 | PDK2 (0.33) | ALDH1A1TSHRCYP1A2 | |
| SCHEMBL18056005 | 0.65 | ALDH1A1 (0.38) | ALDH1A1HSD17B10TSHRHPGDCYP1A2 | |
| SCHEMBL15848335 | 0.64 | ALDH1A1 (0.36) | ALDH1A1HSD17B10TSHRHPGDCYP1A2 | |
| SCHEMBL14262737 | 0.63 | RAD52 (0.41) | ALDH1A1HSD17B10TSHRHPGDCYP1A2 | |
| SCHEMBL18814822 | 0.62 | ALDH1A1 (0.50) | ALDH1A1HSD17B10TSHRHPGDCYP1A2 | |
| SCHEMBL5594716 | 0.62 | RAD52 (0.45) | ALDH1A1HSD17B10TSHRHPGDCYP1A2 | |
| SCHEMBL16404479 | 0.62 | PDK2 (0.30) | — | |
| SCHEMBL31395712 | 0.60 | ALDH1A1 (0.50) | ALDH1A1HSD17B10TSHRHPGDCYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| JP-2003206285-A | NEW 1,1,3,3-TETRAFLUORO-1H,3H-NAPHTHO[1,8-c,d]PYRAN COMPOUND AND METHOD FOR PRODUCING THE SAME | KANTO DENKA KOGYO CO LTD | 2003-07-22 | — | — | JP | disclosed |
| JP-2003206285-A | NEW 1,1,3,3-TETRAFLUORO-1H,3H-NAPHTHO[1,8-c,d]PYRAN COMPOUND AND METHOD FOR PRODUCING THE SAME | KANTO DENKA KOGYO CO LTD | 2003-07-22 | — | — | JP | disclosed |