Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.58 |
| ▸ | CES2 | O00748 | 1/20 | 0.53 |
| ▸ | CES1 | P23141 | 1/20 | 0.53 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.53 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.53 |
| ▸ | CTRC | Q99895 | 1/20 | 0.51 |
| ▸ | UTS2R | Q9UKP6 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 4/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.47 |
| ▸ | MGLL | Q99685 | 2/20 | 0.47 |
| ▸ | SLC1A5 | Q15758 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| Biphenyl SCHEMBL3127994 | 0.98 | CES2 (0.55) | CYP1A2CES2CES1PDCD1CD274 | |
| SCHEMBL247591 | 0.90 | CES2 (0.65) | CES2CES1SMN1; SMN2MAPTL3MBTL1 | |
| SCHEMBL3292238 | 0.90 | PDCD1 (0.62) | CYP1A2PDCD1CD274SMN1; SMN2KDM4E | |
| SCHEMBL3292249 | 0.88 | PDCD1 (0.60) | CYP1A2CES2CES1PDCD1CD274 | |
| SCHEMBL28775846 | 0.85 | CES2 (0.59) | CES2CES1SMN1; SMN2KDM4EMAPT | |
| SCHEMBL247590 | 0.85 | CES2 (0.59) | CES2CES1SMN1; SMN2KDM4EMAPT | |
| SCHEMBL7739094 | 0.84 | PARP10 (0.57) | CYP1A2PDCD1CD274SMN1; SMN2KDM4E | |
| Biphenyl SCHEMBL7862554 | 0.83 | F2 (0.61) | CES2CES1PDCD1CD274SMN1; SMN2 | |
| SCHEMBL19666759 | 0.82 | MAPT (0.62) | PDCD1CD274SMN1; SMN2KDM4EMAPT | |
| SCHEMBL10874927 | 0.82 | SRD5A2 (0.65) | CYP1A2CES2CES1CTRCSMN1; SMN2 |
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-102186475-B | novel inhibitors | 前体生物药物股份公司 | 2016-08-03 | — | — | CN | disclosed |