Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 5/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | GLS | O94925 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.41 |
| ▸ | SCN1A | P35498 | 1/20 | 0.41 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.41 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7568865 | 0.81 | SMN1; SMN2 (0.66) | GAACYP1A2CYP2D6SMN1; SMN2CYP3A4 | |
| SCHEMBL7001422 | 0.79 | CYP1A2 (0.54) | GAACYP1A2CYP2D6SMN1; SMN2CYP3A4 | |
| SCHEMBL3122100 | 0.79 | ALDH1A1 (0.46) | CYP1A2CYP2D6ALDH1A1KDM4ESCN1A | |
| SCHEMBL7001340 | 0.78 | SMN1; SMN2 (0.49) | GAACYP1A2CYP2D6SMN1; SMN2CYP3A4 | |
| SCHEMBL930341 | 0.77 | CYP2D6 (0.47) | CYP1A2CYP2D6MEN1KMT2AALDH1A1 | |
| SCHEMBL16390865 | 0.74 | MAPT (0.44) | CYP1A2SMN1; SMN2CYP3A4KMT2AALDH1A1 | |
| SCHEMBL30689125 | 0.73 | GAA (0.75) | GAAHPGDGLSLMNAKCNH2 | |
| SCHEMBL6994588 | 0.73 | HSD17B10 (0.56) | SMN1; SMN2HPGDMEN1KMT2AALDH1A1 | |
| SCHEMBL3130536 | 0.72 | PDK2 (0.42) | GAASMN1; SMN2ALDH1A1KDM4ELMNA | |
| SCHEMBL9795489 | 0.72 | DNM1 (0.45) | GAACYP1A2CYP2D6CYP3A4HPGD |
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-1127051-A2 | TRICYCLIC PYRAZOLE DERIVATIVES | BASF AKTIENGESELLSCHAFT (DE) | 2001-08-29 | — | — | EP | claimed |
| WO-2000027822-A2 | TRICYCLIC PYRAZOLE DERIVATIVES | BASF AKTIENGESELLSCHAFT (DE) | 2000-05-18 | — | — | WO | claimed |