Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1B1 | Q16678 | 7/20 | 0.71 |
| ▸ | MAPT | P10636 | 3/20 | 0.71 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.71 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.71 |
| ▸ | MAOB | P27338 | 2/20 | 0.71 |
| ▸ | HSPD1 | P10809 | 2/20 | 0.71 |
| ▸ | HSPE1 | P61604 | 2/20 | 0.71 |
| ▸ | MEN1 | O00255 | 2/20 | 0.71 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.71 |
| ▸ | F3 | P13726 | 2/20 | 0.71 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.71 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.71 |
| ▸ | MAOA | P21397 | 1/20 | 0.71 |
| ▸ | TNFRSF1A | P19438 | 3/20 | 0.69 |
| ▸ | PLIN1 | O60240 | 1/20 | 0.69 |
| ▸ | LMNA | P02545 | 1/20 | 0.69 |
| ▸ | BCHE | P06276 | 1/20 | 0.69 |
| ▸ | ACHE | P22303 | 1/20 | 0.69 |
| ▸ | RECQL | P46063 | 1/20 | 0.69 |
| ▸ | PLIN5 | Q00G26 | 1/20 | 0.69 |
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 | |
|---|---|---|---|---|
| SCHEMBL7922950 | 1.00 | CYP1B1 (0.71) | CYP1B1MAPTCYP3A4KMT2AMAOB | |
| SCHEMBL13203412 | 0.88 | CYP1B1 (0.80) | CYP1B1MAPTCYP3A4KMT2AMAOB | |
| SCHEMBL13857113 | 0.87 | F3 (0.75) | CYP1B1MAPTCYP3A4KMT2AMAOB | |
| SCHEMBL5593205 | 0.86 | P4HB (0.79) | CYP1B1MAPTCYP3A4KMT2AMAOB | |
| SCHEMBL6639007 | 0.86 | P4HB (0.79) | CYP1B1MAPTCYP3A4KMT2AMAOB | |
| SCHEMBL2998143 | 0.85 | CYP1B1 (0.57) | CYP1B1MAPTCYP3A4KMT2AMAOB | |
| SCHEMBL7922932 | 0.85 | CYP3A4 (0.71) | CYP1B1MAPTCYP3A4KMT2AMAOB | |
| SCHEMBL7922934 | 0.85 | CYP3A4 (0.71) | CYP1B1MAPTCYP3A4KMT2AMAOB | |
| Resveratrol SCHEMBL27812436 | 0.84 | CYP3A4 (0.79) | CYP1B1MAPTCYP3A4KMT2AMAOB | |
| 4'-Hydroxychalcone SCHEMBL25232573 | 0.83 | CYP1B1 (1.00) | CYP1B1MAPTCYP3A4KMT2AMAOB |
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-101724409-A | Liquid crystal orientation agent, liquid crystal orientation film and forming method thereof, liquid crystal display component and polymer | JSR CORP | 2010-06-09 | — | — | CN | disclosed |
| US-6224788-B1 | AROMATIC UNSATURATED KETONE POLYMERS | JSR CORPORATION (JP) | 2001-05-01 | — | — | US | disclosed |