Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.65 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.65 |
| ▸ | ACLY | P53396 | 4/20 | 0.50 |
| ▸ | HPGD | P15428 | 2/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | BRD4 | O60885 | 2/20 | 0.47 |
| ▸ | BRD2 | P25440 | 2/20 | 0.47 |
| ▸ | BRD3 | Q15059 | 2/20 | 0.47 |
| ▸ | ALPL | P05186 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.46 |
| ▸ | PPIA | P62937 | 1/20 | 0.46 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL6666797 | 0.86 | TSHR (0.60) | TSHRMAPK1ACLYHPGDALPL | |
| SCHEMBL6669808 | 0.85 | TSHR (0.71) | TSHRMAPK1HPGDCYP2C9ALDH1A1 | |
| SCHEMBL23440286 | 0.79 | TSHR (1.00) | TSHRMAPK1CYP1A2CYP2C9ALDH1A1 | |
| SCHEMBL21609152 | 0.78 | KAT6A (0.65) | ACLYBRD4ALPL | |
| SCHEMBL23440311 | 0.77 | TSHR (0.80) | TSHRMAPK1CYP1A2CYP2C9ALDH1A1 | |
| SCHEMBL1027519 | 0.73 | TSHR (0.83) | TSHRMAPK1CYP1A2CYP2C9ALDH1A1 | |
| SCHEMBL5183416 | 0.71 | ALDH1A1 (0.61) | TSHRMAPK1CYP2C9ALDH1A1PPIA | |
| SCHEMBL23440280 | 0.71 | TSHR (0.68) | TSHRMAPK1ACLYHPGDCYP2C9 | |
| SCHEMBL6667306 | 0.71 | MAPK1 (0.76) | TSHRMAPK1CYP2C9ALDH1A1PPIA | |
| SCHEMBL23440297 | 0.71 | TSHR (0.75) | TSHRMAPK1CYP1A2CYP2C9ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004021997-A2 | INHIBITORS OF FUNGAL INVASION | MICROBIA, INC. (US) | 2004-03-18 | — | — | WO | disclosed |