Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 5/20 | 0.53 |
| ▸ | CA2 | P00918 | 5/20 | 0.53 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.52 |
| ▸ | CES2 | O00748 | 2/20 | 0.50 |
| ▸ | CES1 | P23141 | 2/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | GSK3B | P49841 | 1/20 | 0.47 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.47 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.47 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.47 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.47 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.47 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.47 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.47 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.47 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL434843 | 1.00 | CA1 (0.53) | CA1CA2NR1I2CES2CES1 | |
| SCHEMBL8474020 | 1.00 | CA1 (0.53) | CA1CA2NR1I2CES2CES1 | |
| SCHEMBL7486774 | 0.87 | ESR1 (0.44) | CES2CES1SMN1; SMN2HDAC3HDAC1 | |
| SCHEMBL8480763 | 0.87 | CA1 (0.50) | CA1CA2CES2CES1HTT | |
| SCHEMBL8480758 | 0.87 | CA1 (0.50) | CA1CA2CES2CES1HTT | |
| SCHEMBL3250286 | 0.87 | CA1 (0.50) | CA1CA2CES2CES1HTT | |
| SCHEMBL11364817 | 0.85 | HTT (0.53) | CA1CA2CES2CES1HTT | |
| SCHEMBL11364816 | 0.85 | HTT (0.53) | CA1CA2CES2CES1HTT | |
| SCHEMBL27693968 | 0.83 | KMT2A (0.60) | HTTSMN1; SMN2ALDH1A1 | |
| SCHEMBL8092965 | 0.82 | HDAC3 (0.49) | CA1CA2NR1I2CES2CES1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6004988-A | Carboxylic acid derivatives, their preparation and their use | BASF AKTIENGESELLSCHAFT (DE) | 1999-12-21 | — | — | US | disclosed |