Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 4/20 | 0.51 |
| ▸ | CCR2 | P41597 | 1/20 | 0.51 |
| ▸ | P2RX4 | Q99571 | 1/20 | 0.50 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.47 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | RGS12 | O14924 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | GNAI1 | P63096 | 1/20 | 0.47 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL606151 | 1.00 | IDO1 (0.51) | IDO1CCR2P2RX4PTGS1PTGS2 | |
| SCHEMBL10036738 | 0.86 | IDO1 (0.55) | IDO1P2RX4PTGS2MEN1ALDH1A1 | |
| SCHEMBL3932038 | 0.84 | KDM4E (0.56) | IDO1P2RX4PTGS1PTGS2MAPT | |
| SCHEMBL2859999 | 0.84 | KDM4E (0.53) | P2RX4MAPTALDH1A1LMNATSHR | |
| SCHEMBL9046095 | 0.83 | PLA2G2A (0.46) | PTGS1PTGS2MAPTMEN1RGS12 | |
| SCHEMBL2860677 | 0.83 | P2RX4 (0.68) | IDO1P2RX4MEN1ALDH1A1MAPK1 | |
| SCHEMBL3929699 | 0.83 | IDO1 (0.60) | IDO1ALDH1A1KMT2APOLBCD74 | |
| SCHEMBL5535346 | 0.83 | IDO1 (0.54) | IDO1P2RX4MAPTKMT2APOLB | |
| SCHEMBL31019833 | 0.82 | CCR2 (0.58) | CCR2P2RX4PTGS1PTGS2MAPT | |
| SCHEMBL4847252 | 0.80 | PDE1B (0.47) | MAPT |
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 |
|---|---|---|---|---|---|---|---|
| CN-118055923-A | Benzodiazepine derivatives as positive allosteric modulators of the GABAA γ1 receptor | 豪夫迈·罗氏有限公司 | 2024-05-17 | — | — | CN | disclosed |