Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC4 | P56524 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 3/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | ACHE | P22303 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | MAP2K7 | O14733 | 1/20 | 0.32 |
| ▸ | GMNN | O75496 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7868496 | 0.82 | CYP19A1 (0.33) | ACHEMAPTCYP3A4TDP1 | |
| SCHEMBL7196023 | 0.80 | HDAC4 (0.42) | HDAC4HDAC2HDAC8KDM4EALDH1A1 | |
| Acetone SCHEMBL9496469 | 0.76 | HDAC4 (0.44) | HDAC4HDAC2HDAC8KDM4EALDH1A1 | |
| Acetonitrile SCHEMBL5698028 | 0.76 | KDM4E (0.38) | HDAC4HDAC2HDAC8KDM4EALDH1A1 | |
| Acetic Acid SCHEMBL2455133 | 0.74 | KDM4E (0.43) | HDAC4HDAC2HDAC8KDM4EALDH1A1 | |
| 1,4-Dimethoxybenzene SCHEMBL28441075 | 0.72 | CA1 (0.65) | KDM4EALDH1A1MAPK1RAB9ANPC1 | |
| SCHEMBL7428480 | 0.72 | HDAC4 (0.41) | HDAC4HDAC2HDAC8KDM4EALDH1A1 | |
| 1,4-Dimethoxybenzene SCHEMBL9648022 | 0.72 | CA1 (0.65) | KDM4EALDH1A1MAPK1RAB9ANPC1 | |
| Acetic Acid Methyl Ester SCHEMBL27436310 | 0.72 | ALDH1A1 (0.50) | HDAC4HDAC2HDAC8KDM4EALDH1A1 | |
| SCHEMBL642228 | 0.70 | HDAC4 (0.58) | HDAC4HDAC2HDAC8KDM4EALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1292623-A2 | POLYMERIZATION OF OLEFINS | E. I. du Pont de Nemours and Company (US) | 2003-03-19 | — | — | EP | disclosed |
| WO-2001092347-A2 | POLYMERIZATION OF OLEFINS | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 2001-12-06 | — | — | WO | disclosed |