Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN1 | Q05586 | 1/20 | 0.44 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.44 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | ROCK2 | O75116 | 5/20 | 0.42 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.41 |
| ▸ | SYK | P43405 | 1/20 | 0.41 |
| ▸ | HTR2C | P28335 | 1/20 | 0.41 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.41 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | CASR | P41180 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL3573364 | 0.85 | PYGL (0.45) | GRIN1GRIN2BFFAR4SMN1; SMN2POLB | |
| SCHEMBL5788 | 0.84 | FFAR4 (0.44) | GRIN1GRIN2BFFAR4SMN1; SMN2POLB | |
| SCHEMBL3574563 | 0.84 | TTR (0.45) | GRIN1GRIN2BFFAR4SMN1; SMN2POLB | |
| SCHEMBL27815745 | 0.83 | CYP1A1 (0.46) | SMN1; SMN2HPGDCYP1A1CYP1B1ALDH1A1 | |
| SCHEMBL5802 | 0.83 | FFAR4 (0.45) | GRIN1GRIN2BFFAR4SMN1; SMN2POLB | |
| SCHEMBL8563139 | 0.76 | CYP1A1 (0.62) | SMN1; SMN2SYKCYP1A1CYP1B1ALDH1A1 | |
| SCHEMBL7668150 | 0.75 | CYP4F2 (0.46) | SMN1; SMN2RAB9A | |
| SCHEMBL25297097 | 0.75 | IMPDH2 (0.46) | SYKCYP1A1CYP1B1ALDH1A1 | |
| SCHEMBL22530493 | 0.75 | ESR1 (0.65) | SYKCYP1A1CYP1B1 | |
| SCHEMBL29392744 | 0.75 | ESR1 (0.65) | SYKCYP1A1CYP1B1 |
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-101454695-A | Photochromic materials comprising haloalkyl groups | TRANSITIONS OPTICAL INC (US) | 2009-06-10 | — | — | CN | disclosed |