Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TBXA2R | P21731 | 4/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | GFER | P55789 | 1/20 | 0.38 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | BCHE | P06276 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL28294254 | 1.00 | TBXA2R (0.42) | TBXA2RKMT2AMEN1ALDH1A1POLB | |
| SCHEMBL2729935 | 0.79 | ADRA2A (0.59) | KMT2AMEN1POLBSMN1; SMN2CYP1A2 | |
| SCHEMBL28267335 | 0.72 | ESR1 (0.55) | KMT2AMEN1ALDH1A1POLBSMN1; SMN2 | |
| SCHEMBL9957060 | 0.72 | TBXA2R (0.40) | TBXA2RKMT2AMEN1ALDH1A1HTT | |
| SCHEMBL18797369 | 0.69 | KMT2A (0.40) | KMT2AMEN1POLBHPGDPLAU | |
| SCHEMBL16229870 | 0.69 | ADRA2A (0.58) | KMT2AMEN1ALDH1A1POLBPKM | |
| SCHEMBL14911726 | 0.68 | PLAU (0.42) | KMT2AMEN1POLBPKMHPGD | |
| SCHEMBL15018062 | 0.68 | AGTR1 (0.36) | TBXA2RKMT2AMEN1ALDH1A1SMN1; SMN2 | |
| SCHEMBL30781991 | 0.68 | ASIC3 (0.49) | KMT2AMEN1GFERSMN1; SMN2PLAU | |
| SCHEMBL30949907 | 0.67 | KDM4C (0.54) | ALDH1A1MAPTPLAU |
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-109689647-B | Bicyclic heteroaryl substituted compounds | 百时美施贵宝公司 | 2023-01-20 | — | — | CN | disclosed |