Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | ELANE | P08246 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.44 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | CA7 | P43166 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.43 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.43 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.43 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.43 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL6163307 | 0.80 | SMN1; SMN2 (0.47) | TSHRSMN1; SMN2MAPK1NPSR1ELANE | |
| SCHEMBL28306812 | 0.79 | CA12 (0.61) | TSHRSMN1; SMN2NPSR1ELANEMAPT | |
| SCHEMBL1365179 | 0.79 | CA12 (0.61) | TSHRSMN1; SMN2NPSR1ELANEMAPT | |
| SCHEMBL18796656 | 0.77 | PDE3B (0.73) | TSHRSMN1; SMN2MAPK1NPSR1MAPT | |
| SCHEMBL286232 | 0.77 | CA12 (0.49) | TSHRSMN1; SMN2MAPK1NPSR1ELANE | |
| SCHEMBL13563786 | 0.76 | KDM4E (0.47) | TSHRSMN1; SMN2MAPK1NPSR1ELANE | |
| SCHEMBL6166501 | 0.76 | MAPT (0.47) | TSHRSMN1; SMN2MAPK1NPSR1ELANE | |
| SCHEMBL2997892 | 0.75 | CA12 (0.56) | TSHRSMN1; SMN2NPSR1ELANEMAPT | |
| SCHEMBL6883767 | 0.75 | TSHR (0.55) | TSHRSMN1; SMN2MAPK1NPSR1ELANE | |
| SCHEMBL7939524 | 0.75 | CYP2C9 (0.51) | TSHRSMN1; SMN2MAPK1NPSR1ELANE |
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-2012085170-A2 | PROCESS FOR MAKING ORGANOBORON COMPOUNDS, PRODUCTS OBTAINABLE THEREBY, AND THEIR USE | HAAG BENJAMIN (DE) | 2012-06-28 | — | — | WO | disclosed |