Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | THRB | P10828 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.30 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.30 |
| ▸ | HCAR2 | Q8TDS4 | 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 | |
|---|---|---|---|---|
| SCHEMBL5602141 | 0.98 | KCNH2 (0.41) | KCNH2ALDH1A1PKMHPGDTSHR | |
| SCHEMBL12658597 | 0.75 | — | — | |
| SCHEMBL3067540 | 0.70 | KCNH2 (0.34) | KCNH2ALDH1A1PKMHPGDTDP1 | |
| SCHEMBL3064061 | 0.68 | KCNH2 (0.38) | KCNH2ALDH1A1PKMHPGDTSHR | |
| SCHEMBL92739 | 0.64 | KCNH2 (0.46) | KCNH2ALDH1A1PKMHPGDMEN1 | |
| SCHEMBL31054446 | 0.62 | KCNH2 (0.50) | KCNH2ALDH1A1PKMHPGDTSHR | |
| SCHEMBL7711334 | 0.62 | KCNH2 (0.50) | KCNH2ALDH1A1PKMHPGDTSHR | |
| SCHEMBL5679424 | 0.59 | TSHR (0.50) | KCNH2ALDH1A1HPGDTSHRTHRB | |
| Hexamethylbenzene SCHEMBL27477496 | 0.58 | TSHR (0.58) | ALDH1A1MEN1KMT2ATSHRTHRB | |
| Hexane SCHEMBL27775231 | 0.57 | — | — |
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 3 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 | claimed |
| 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 |