Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS2 | P35228 | 1/20 | 0.49 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.42 |
| ▸ | HTR2C | P28335 | 7/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | HTR1A | P08908 | 2/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.35 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.35 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.35 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.34 |
| ▸ | HRH1 | P35367 | 1/20 | 0.34 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.34 |
| ▸ | CDK9 | P50750 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL22605562 | 0.76 | GABRA1 (0.51) | SLC18A3SIGMAR1MEN1KMT2AGABRA1 | |
| SCHEMBL21339622 | 0.76 | HTR2C (0.46) | HTR2CMEN1KMT2ASLC6A2SLC6A4 | |
| SCHEMBL13816894 | 0.73 | SLC18A3 (0.44) | SLC18A3SIGMAR1HTR2CMEN1KMT2A | |
| SCHEMBL9178572 | 0.73 | NISCH (0.46) | NOS2HTR1A | |
| SCHEMBL11777587 | 0.72 | DRD2 (0.43) | SLC18A3SIGMAR1HTR2CMEN1KMT2A | |
| SCHEMBL20424056 | 0.67 | SLC18A3 (0.44) | SLC18A3SIGMAR1HTR2CMEN1KMT2A | |
| SCHEMBL15650452 | 0.66 | NOS2 (0.60) | NOS2MEN1KMT2AGABRA1GABRB2 | |
| SCHEMBL7940885 | 0.66 | NOS2 (1.00) | NOS2 | |
| Hydrochloric Acid SCHEMBL8382199 | 0.65 | NOS2 (0.96) | NOS2 | |
| SCHEMBL13585229 | 0.63 | NOS2 (0.56) | NOS2GABRA1GABRB2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019170543-A1 | IDENTIFICATION AND USE OF ERK5 INHIBITORS | BAYER AKTIENGESELLSCHAFT (DE) | 2019-09-12 | — | — | WO | disclosed |