Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.51 |
| ▸ | TSHR | P16473 | 3/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | MMP8 | P22894 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | IDO1 | P14902 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL29617349 | 1.00 | CYP1A2 (0.51) | CYP1A2TSHRCYP2C19PIN1POLB | |
| SCHEMBL28637793 | 1.00 | CYP1A2 (0.51) | CYP1A2TSHRCYP2C19PIN1POLB | |
| SCHEMBL27894880 | 0.86 | TSHR (0.68) | CYP1A2TSHRCYP2C19PIN1POLB | |
| SCHEMBL2457716 | 0.86 | TSHR (0.51) | CYP1A2TSHRCYP2C19PIN1POLB | |
| SCHEMBL19465642 | 0.83 | CYP1A2 (0.46) | CYP1A2TSHRCYP2C19PIN1POLB | |
| SCHEMBL6974072 | 0.83 | TSHR (0.46) | CYP1A2TSHRCYP2C19PIN1POLB | |
| SCHEMBL29617345 | 0.82 | CYP1A2 (0.45) | CYP1A2TSHRCYP2C19PIN1POLB | |
| SCHEMBL28926885 | 0.82 | CYP1A2 (0.45) | CYP1A2TSHRCYP2C19PIN1POLB | |
| SCHEMBL25301977 | 0.81 | CYP1A2 (0.44) | CYP1A2TSHRCYP2C19PIN1POLB | |
| SCHEMBL30522607 | 0.81 | CYP1A2 (0.44) | CYP1A2TSHRCYP2C19PIN1POLB |
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 |
|---|---|---|---|---|---|---|---|
| EP-3994144-A1 | A NEW PROCESS FOR SYNTHESIZING C2 BRIDGED CYCLOPENTADIENYL LIGANDS AND CORRESPONDING ANSA-METALLOCENE CATALYSTS | Haldia Petrochemicals Limited (IN) | 2022-05-11 | — | — | EP | disclosed |