Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.59 |
| ▸ | HTT | P42858 | 1/20 | 0.59 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.59 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.59 |
| ▸ | HDAC1 | Q13547 | 8/20 | 0.56 |
| ▸ | HDAC6 | Q9UBN7 | 7/20 | 0.56 |
| ▸ | HDAC2 | Q92769 | 6/20 | 0.56 |
| ▸ | HDAC10 | Q969S8 | 6/20 | 0.56 |
| ▸ | HDAC8 | Q9BY41 | 6/20 | 0.56 |
| ▸ | CA2 | P00918 | 2/20 | 0.56 |
| ▸ | HDAC3 | O15379 | 5/20 | 0.51 |
| ▸ | HDAC4 | P56524 | 5/20 | 0.51 |
| ▸ | HDAC7 | Q8WUI4 | 5/20 | 0.51 |
| ▸ | HDAC11 | Q96DB2 | 5/20 | 0.51 |
| ▸ | HDAC9 | Q9UKV0 | 5/20 | 0.51 |
| ▸ | HDAC5 | Q9UQL6 | 5/20 | 0.51 |
| ▸ | F7 | P08709 | 1/20 | 0.51 |
| ▸ | MMP8 | P22894 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL9242992 | 0.83 | ALDH1A1 (0.61) | ALDH1A1KDM4EHTTHDAC1HDAC6 | |
| SCHEMBL2755878 | 0.83 | ALDH1A1 (0.66) | ALDH1A1KDM4EHTTCYP2C9CYP2C19 | |
| SCHEMBL9175529 | 0.81 | ALDH1A1 (0.51) | ALDH1A1KDM4EHTTCYP2C9CYP2C19 | |
| SCHEMBL2701620 | 0.80 | ALDH1A1 (0.76) | ALDH1A1KDM4EHTTHDAC1HDAC6 | |
| Hydrochloric Acid SCHEMBL8005031 | 0.80 | ALDH1A1 (0.51) | ALDH1A1KDM4EHTTHDAC1HDAC6 | |
| SCHEMBL16573398 | 0.80 | HDAC1 (0.76) | ALDH1A1KDM4EHTTHDAC1HDAC6 | |
| SCHEMBL21091969 | 0.80 | ALDH1A1 (0.88) | ALDH1A1KDM4EHTTHDAC1HDAC6 | |
| SCHEMBL27581167 | 0.80 | HDAC1 (0.50) | ALDH1A1KDM4ECYP2C9CYP2C19HDAC1 | |
| Hydrochloric Acid SCHEMBL8005027 | 0.79 | HDAC1 (0.55) | ALDH1A1KDM4EHTTHDAC1HDAC6 | |
| SCHEMBL9911471 | 0.79 | ERCC1 (0.57) | ALDH1A1KDM4EHTTHDAC1HDAC6 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012020220-A1 | COMPOUNDS | NOVACTA BIOSYSTEMS LIMITED (GB) | 2012-02-16 | — | — | WO | claimed |
| CN-1466569-A | Novel 3-substituted urea derivatives and pharmaceutical use thereof | ������ҩ��ʽ���� | 2004-01-07 | — | — | CN | claimed |
| WO-2012020220-A1 | COMPOUNDS | NOVACTA BIOSYSTEMS LIMITED (GB) | 2012-02-16 | — | — | WO | disclosed |
| CN-1466569-A | Novel 3-substituted urea derivatives and pharmaceutical use thereof | ������ҩ��ʽ���� | 2004-01-07 | — | — | CN | disclosed |