Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | HCAR2 | Q8TDS4 | 3/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | BLM | P54132 | 2/20 | 0.34 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.33 |
| ▸ | LSS | P48449 | 2/20 | 0.32 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.31 |
| ▸ | GMNN | O75496 | 1/20 | 0.31 |
| ▸ | USP2 | O75604 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | APEX1 | P27695 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | RECQL | P46063 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL27700387 | 0.82 | ALDH1A1 (0.35) | HCAR2ALDH1A1KMT2A | |
| SCHEMBL10171416 | 0.77 | PLA2G2A (0.49) | TSHRHCAR2BLMPLA2G2AALDH1A1 | |
| SCHEMBL8680666 | 0.76 | TSHR (0.39) | TSHRHPGDHCAR2ALDH1A1 | |
| SCHEMBL28463600 | 0.75 | GPR84 (0.42) | TSHRBLMALDH1A1GMNNUSP2 | |
| SCHEMBL13536933 | 0.74 | TSHR (0.43) | TSHRHCAR2ALDH1A1KMT2A | |
| SCHEMBL7383760 | 0.74 | TSHR (0.46) | TSHRHPGDHCAR2ATMBLM | |
| SCHEMBL345325 | 0.74 | PLA2G2A (0.46) | TSHRHCAR2BLMPLA2G2AALDH1A1 | |
| SCHEMBL10171287 | 0.72 | BLM (0.37) | TSHRHCAR2BLMPLA2G2AALDH1A1 | |
| SCHEMBL9492380 | 0.72 | TSHR (0.35) | TSHRHCAR2ALDH1A1 | |
| SCHEMBL9093646 | 0.71 | BLM (0.39) | TSHRBLMPLA2G2AALDH1A1CYP2C19 |
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-1648873-A4 | NEUROPROTECTIVE MACROCYLIC COMPOUNDS AND METHODS FOR THEIR USE | NEUREN PHARMACEUTICALS LTD (NZ) | 2008-06-25 | — | — | EP | disclosed |
| EP-1648873-A2 | NEUROPROTECTIVE MACROCYLIC COMPOUNDS AND METHODS FOR THEIR USE | Neuronz Limited (NZ) | 2006-04-26 | — | — | EP | disclosed |
| WO-2004084809-A2 | NEUROPROTECTIVE MACROCYLIC COMPOUNDS AND METHODS FOR THEIR USE | NEUREN PHARMACEUTICALS LTD. (NZ) | 2004-10-07 | — | — | WO | disclosed |