Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NSD2 | O96028 | 2/20 | 0.51 |
| ▸ | MAOA | P21397 | 1/20 | 0.49 |
| ▸ | MAOB | P27338 | 1/20 | 0.49 |
| ▸ | CTBP2 | P56545 | 1/20 | 0.47 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.47 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.47 |
| ▸ | VNN1 | O95497 | 1/20 | 0.46 |
| ▸ | RXRA | P19793 | 1/20 | 0.46 |
| ▸ | RXRG | P48443 | 1/20 | 0.46 |
| ▸ | MMP12 | P39900 | 1/20 | 0.46 |
| ▸ | MMP13 | P45452 | 1/20 | 0.46 |
| ▸ | MMP3 | P08254 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | PTGDR2 | Q9Y5Y4 | 2/20 | 0.43 |
| ▸ | MMP2 | P08253 | 1/20 | 0.43 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.43 |
| ▸ | EPHX2 | P34913 | 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 | |
|---|---|---|---|---|
| SCHEMBL9190571 | 0.95 | NSD2 (0.55) | NSD2MAOAMAOBCTBP2CYP11B1 | |
| SCHEMBL6937899 | 0.86 | CTBP2 (0.59) | CTBP2MMP12MMP13SAE1UBA2 | |
| SCHEMBL27675295 | 0.86 | GAA (0.52) | MAOBCTBP2RXRARXRGKDM4E | |
| SCHEMBL17857804 | 0.82 | KMT2A (0.58) | NSD2MAOAMAOBCTBP2CYP11B1 | |
| SCHEMBL526194 | 0.80 | GAA (0.57) | CTBP2KDM4EALDH1A1POLBGAA | |
| SCHEMBL7929151 | 0.80 | MMP3 (0.58) | MAOAMAOBCYP11B1CYP11B2MMP3 | |
| SCHEMBL20941548 | 0.79 | GAA (0.60) | POLBGAASAE1UBA2TSHR | |
| SCHEMBL8185095 | 0.79 | HTT (0.62) | CTBP2RXRARXRGMMP12MMP13 | |
| SCHEMBL9641208 | 0.79 | CTBP2 (0.57) | MAOAMAOBCTBP2SAE1UBA2 | |
| SCHEMBL17857729 | 0.77 | TSHR (0.62) | NSD2MAOAMAOBCYP11B1CYP11B2 |
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-20180022996-A1 | BIMESOGENIC COMPOUNDS AND MESOGENIC MEDIA | MERCK PATENT GMBH (DE) | 2018-01-25 | — | — | US | disclosed |
| US-20180022996-A1 | BIMESOGENIC COMPOUNDS AND MESOGENIC MEDIA | MERCK PATENT GMBH (DE) | 2018-01-25 | — | — | US | disclosed |