Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.36 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | CETP | P11597 | 1/20 | 0.34 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8677100 | 0.90 | HPGD (0.34) | HPGDCYP2C19P2RX7OPRM1ALDH1A1 | |
| Butadiene SCHEMBL8676911 | 0.90 | HPGD (0.37) | HPGDCYP2C19P2RX7OPRM1ALDH1A1 | |
| SCHEMBL8678562 | 0.89 | HPGD (0.38) | HPGDCYP2C19OPRM1ALDH1A1SMN1; SMN2 | |
| SCHEMBL8678044 | 0.81 | KDM1A (0.34) | HPGDOPRM1ALDH1A1SMN1; SMN2HDAC3 | |
| SCHEMBL8678235 | 0.79 | CYP2C19 (0.41) | HPGDCYP2C19P2RX7OPRM1ALDH1A1 | |
| SCHEMBL8677532 | 0.78 | KDM4E (0.31) | SMN1; SMN2CYP3A4KDM4EMEN1KMT2A | |
| SCHEMBL8678560 | 0.76 | SIGMAR1 (0.32) | — | |
| SCHEMBL8679145 | 0.76 | — | — | |
| SCHEMBL8677152 | 0.73 | SMN1; SMN2 (0.37) | HPGDCYP2C19P2RX7OPRM1ALDH1A1 | |
| SCHEMBL8678333 | 0.72 | HTT (0.34) | OPRM1ALDH1A1HDAC3HDAC1HDAC2 |
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-5770538-A | Group 4 metal diene complexes and addition polymerization catalysts therefrom | THE DOW CHEMICAL COMPANY (US) | 1998-06-23 | — | — | US | disclosed |
| US-5539068-A | Group 4, metal-conjugated diene metallocyclopentene complexes, and addition polymerization catalysts therefrom | THE DOW CHEMICAL COMPANY (US) | 1996-07-23 | — | — | US | disclosed |