Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 6/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | USP2 | O75604 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 2/20 | 0.32 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.31 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.31 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.31 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.30 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.30 |
| ▸ | ADRB3 | P13945 | 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 | |
|---|---|---|---|---|
| SCHEMBL9508778 | 1.00 | MAPT (0.48) | MAPTCYP3A4CYP2C9TDP1TSHR | |
| SCHEMBL9511070 | 0.98 | MAPT (0.46) | MAPTCYP3A4CYP2C9TDP1TSHR | |
| SCHEMBL9507562 | 0.95 | MAPT (0.43) | MAPTCYP3A4CYP2C9TDP1TSHR | |
| SCHEMBL8650440 | 0.86 | TSHR (0.57) | TDP1TSHRLMNACA1ABCB1 | |
| SCHEMBL28840191 | 0.86 | TSHR (0.57) | TDP1TSHRLMNACA1ABCB1 | |
| SCHEMBL7165375 | 0.86 | TSHR (0.57) | TDP1TSHRLMNACA1ABCB1 | |
| SCHEMBL4957257 | 0.84 | TSHR (0.54) | TDP1TSHRALDH1A1HPGDLMNA | |
| SCHEMBL11519762 | 0.82 | TDP1 (0.44) | MAPTCYP3A4CYP2C9TDP1TSHR | |
| SCHEMBL12913888 | 0.82 | TSHR (0.51) | CYP3A4TDP1TSHRHPGDLMNA | |
| Methylene Chloride SCHEMBL28116180 | 0.82 | TSHR (0.53) | TDP1TSHRALDH1A1LMNACA1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0388960-B1 | OPTICALLY ACTIVE COMPOUNDS AND THEIR PREPARATION AND USE | HITACHI, LTD. (JP) | 1993-10-06 | — | — | EP | disclosed |
| US-5152919-A | Stability, chemical resistance, high speed response, large spo ntaneous polarization, molecular orientation and wide temperat ure range | HITACHI, LTD. (JP) | 1992-10-06 | — | — | US | disclosed |
| EP-0388960-A1 | Optically active compounds and their preparation and use | HITACHI, LTD. (JP) | 1990-09-26 | — | — | EP | disclosed |