Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 1/20 | 0.36 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.31 |
| ▸ | GLA | P06280 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | G6PD | P11413 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL5599772 | 0.79 | ADRA2A (0.35) | NOTUMADRA2AADRA1AALDH1A1KDM4E | |
| SCHEMBL5602509 | 0.78 | KDM4E (0.33) | ALDH1A1KDM4ESMN1; SMN2LMNA | |
| Hydrochloric Acid SCHEMBL5603489 | 0.77 | ADRA2A (0.36) | NOTUMADRA2AADRA1AALDH1A1KDM4E | |
| SCHEMBL5603495 | 0.77 | NOTUM (0.36) | NOTUMADRA2AADRA1AALDH1A1KDM4E | |
| SCHEMBL5599775 | 0.77 | NOTUM (0.36) | NOTUMADRA2AADRA1AALDH1A1KDM4E | |
| SCHEMBL5601410 | 0.76 | — | — | |
| Hydrochloric Acid SCHEMBL5602671 | 0.76 | NOTUM (0.38) | NOTUMADRA2AADRA1AALDH1A1KDM4E | |
| SCHEMBL5603826 | 0.75 | CYP11B2 (0.41) | NOTUMALDH1A1MAPK1HDAC4MEN1 | |
| SCHEMBL5603675 | 0.75 | NOTUM (0.40) | NOTUMALDH1A1KDM4ERAB9AMEN1 | |
| SCHEMBL5602512 | 0.74 | — | — |
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-7276567-B2 | Heterocyclic substituted metallocene compounds for olefin polymerization | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2007-10-02 | — | — | US | disclosed |
| US-20050261449-A1 | Heterocyclic substituted metallocene compounds for olefin polymerization | EXXONMOBIL CHEMICAL PATENT INC. | 2005-11-24 | — | — | US | disclosed |