Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 3/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.31 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | HPGD | P15428 | 2/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.31 |
| ▸ | MAT2A | P31153 | 1/20 | 0.31 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.30 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL17486348 | 0.93 | MEN1 (0.35) | MEN1KMT2ASMN1; SMN2NPSR1ALDH1A1 | |
| SCHEMBL17486349 | 0.88 | KDM4E (0.37) | MEN1KMT2ASMN1; SMN2TSHRALDH1A1 | |
| SCHEMBL17486270 | 0.85 | MEN1 (0.38) | MEN1KMT2ASMN1; SMN2TSHRNPSR1 | |
| SCHEMBL17486006 | 0.85 | ALDH1A1 (0.34) | SMN1; SMN2TSHRALDH1A1MAPT | |
| SCHEMBL17486350 | 0.83 | CYP2A6 (0.39) | SMN1; SMN2MAPT | |
| SCHEMBL17486202 | 0.81 | RARG (0.35) | MEN1KMT2ASMN1; SMN2ALDH1A1MAPT | |
| SCHEMBL17486212 | 0.81 | MEN1 (0.34) | MEN1KMT2ASMN1; SMN2NPSR1ALDH1A1 | |
| SCHEMBL17486019 | 0.81 | ALDH1A1 (0.33) | MEN1KMT2ASMN1; SMN2ALDH1A1 | |
| SCHEMBL17486251 | 0.79 | — | — | |
| SCHEMBL17486354 | 0.78 | CYP1A2 (0.41) | — |
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-2016015815-A1 | METAL COMPLEXES | MERCK PATENT GMBH (DE) | 2016-02-04 | — | — | WO | disclosed |