Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.66 |
| ▸ | ACHE | P22303 | 2/20 | 0.57 |
| ▸ | PDE2A | O00408 | 1/20 | 0.50 |
| ▸ | SLC18A2 | Q05940 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 2/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.43 |
| ▸ | TMEM97 | Q5BJF2 | 2/20 | 0.43 |
| ▸ | FAAH | O00519 | 2/20 | 0.42 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.42 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.42 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.42 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL15081975 | 1.00 | TSHR (0.66) | TSHRACHEPDE2ASLC18A2MEN1 | |
| SCHEMBL15081998 | 0.86 | GAA (0.57) | TSHRHTT | |
| SCHEMBL15081977 | 0.84 | TSHR (0.46) | TSHRACHEMEN1KMT2AKDM4E | |
| SCHEMBL15081995 | 0.83 | ALDH1A1 (0.56) | TSHRACHEPDE2AMEN1KMT2A | |
| SCHEMBL15081956 | 0.82 | ALDH1A1 (0.55) | TSHRACHEPDE2AMEN1KMT2A | |
| SCHEMBL15084316 | 0.82 | TSHR (0.71) | TSHRACHEPDE2AMEN1KMT2A | |
| SCHEMBL17084169 | 0.81 | ALDH1A1 (0.56) | PDE2AMEN1KMT2APOLBALDH1A1 | |
| SCHEMBL15081955 | 0.81 | ALDH1A1 (0.56) | PDE2AMEN1KMT2AKDM4EHTT | |
| SCHEMBL15081936 | 0.81 | ALDH1A1 (0.56) | PDE2AMEN1KMT2APOLBALDH1A1 | |
| SCHEMBL15081978 | 0.81 | ALDH1A1 (0.50) | TSHRMEN1KMT2AKDM4EALDH1A1 |
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-2012036997-A1 | FUSED PYRAZOLE DERIVATIVES AS NOVEL ERK INHIBITORS | SCHERING CORPORATION (US) | 2012-03-22 | — | — | WO | disclosed |