Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRK6 | P43250 | 4/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.33 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.33 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.33 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.33 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.33 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.33 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.32 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.32 |
| ▸ | TUBB | P07437 | 1/20 | 0.32 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.32 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.32 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.32 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.32 |
| ▸ | TUBB3 | Q13509 | 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 | |
|---|---|---|---|---|
| SCHEMBL8188505 | 0.82 | KDM4E (0.36) | MAPTFYNCYP1A2KDM4EALDH1A1 | |
| SCHEMBL8187508 | 0.80 | MEN1 (0.33) | MEN1CYP1A2CYP2C9CYP2C19KMT2A | |
| SCHEMBL8196758 | 0.80 | MEN1 (0.33) | MAPTMEN1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL8188363 | 0.77 | FYN (0.38) | MAPTFYNALDH1A1 | |
| SCHEMBL8199147 | 0.76 | KMO (0.36) | GRK6MAPTMEN1KMT2AHTT | |
| SCHEMBL8201315 | 0.76 | KDM4E (0.34) | MAPTFYNKDM4EALDH1A1 | |
| SCHEMBL8195802 | 0.75 | NR1H2 (0.37) | MAPTFYNKMT2ASMN1; SMN2ALDH1A1 | |
| SCHEMBL8187466 | 0.71 | PTGS2 (0.39) | MEN1KMT2ASMN1; SMN2ALDH1A1 | |
| SCHEMBL8195825 | 0.70 | PTGS2 (0.38) | MEN1KMT2AHTTSMN1; SMN2ALDH1A1 | |
| SCHEMBL8200042 | 0.69 | AR (0.37) | ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2000018741-A2 | PYRAZOLE COMPOUNDS AS COX-2 INHIBITORS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2000-04-06 | — | — | WO | disclosed |