Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.40 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.38 |
| ▸ | MEN1 | O00255 | 3/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | HTR1A | P08908 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.37 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.37 |
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.37 |
| ▸ | HTR2C | P28335 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9368842 | 0.88 | NLRP3 (0.43) | NLRP3AKR1B1KMT2AMEN1ATM | |
| SCHEMBL9376554 | 0.80 | NLRP3 (0.38) | NLRP3HTTHSD17B10ALDH1A1NPC1 | |
| SCHEMBL9482977 | 0.79 | RORC (0.42) | NLRP3AKR1B1KMT2AMEN1CYP3A4 | |
| SCHEMBL1429298 | 0.76 | AKR1B1 (0.55) | NLRP3AKR1B1KMT2AMEN1ATM | |
| SCHEMBL9369590 | 0.75 | MAPK1 (0.43) | NLRP3AKR1B1KMT2AMEN1ATM | |
| SCHEMBL9369588 | 0.75 | KMT2A (0.40) | NLRP3AKR1B1KMT2AMEN1ATM | |
| Ammonia Solution, Strong SCHEMBL27532390 | 0.75 | AKR1B1 (0.53) | NLRP3AKR1B1KMT2AMEN1ATM | |
| SCHEMBL9373305 | 0.74 | RORC (0.41) | NLRP3AKR1B1KMT2AMEN1ATM | |
| SCHEMBL8744771 | 0.73 | RORC (0.46) | NLRP3AKR1B1KMT2AMEN1HTT | |
| SCHEMBL9368074 | 0.72 | RORC (0.46) | NLRP3AKR1B1KMT2AMEN1HTT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5186737-A | Herbicides | BAYER AKTIENGESELLSCHAFT (DE) | 1993-02-16 | — | — | US | disclosed |
| US-5045560-A | Insecticides, nematocides, fungicides, herbicides, human and veterinary medicine | BAYER AKTIENGESELLSCHAFT (DE) | 1991-09-03 | — | — | US | disclosed |