Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAPRT | Q6XQN6 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | ASPH | Q12797 | 1/20 | 0.38 |
| ▸ | KDM8 | Q8N371 | 1/20 | 0.38 |
| ▸ | ESR1 | P03372 | 1/20 | 0.37 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.37 |
| ▸ | ALB | P02768 | 1/20 | 0.36 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.36 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.36 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | DHODH | Q02127 | 2/20 | 0.35 |
| ▸ | CDK2 | P24941 | 1/20 | 0.35 |
| ▸ | MYC | P01106 | 1/20 | 0.34 |
| ▸ | PRKCI | P41743 | 1/20 | 0.33 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.33 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.33 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7553486 | 0.88 | ALDH1A1 (0.37) | NAPRTKDM4EASPHKDM8ESR1 | |
| SCHEMBL8813141 | 0.86 | NAPRT (0.44) | NAPRTKDM4EESR1ESR2KMT2A | |
| SCHEMBL8802087 | 0.86 | NAPRT (0.46) | NAPRTKDM4EASPHKDM8KMT2A | |
| SCHEMBL7553608 | 0.81 | NAPRT (0.46) | NAPRTKMT2ACYP3A4CYP2C9CDK2 | |
| SCHEMBL7548361 | 0.80 | NAPRT (0.53) | NAPRTKDM4EKMT2ACYP3A4CYP2C9 | |
| SCHEMBL8798744 | 0.79 | NAPRT (0.44) | NAPRTKDM4EASPHKDM8KMT2A | |
| SCHEMBL7550390 | 0.76 | KEAP1 (0.42) | NAPRTKDM4EASPHKDM8ESR1 | |
| SCHEMBL7548942 | 0.76 | KEAP1 (0.39) | NAPRTKDM4EASPHKDM8KMT2A | |
| SCHEMBL7548594 | 0.75 | RECQL (0.48) | NAPRTKMT2APRKCI | |
| SCHEMBL8610741 | 0.75 | CNR2 (0.50) | NAPRTCDK2 |
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-1997049708-A9 | TRICYCLIC BENZAZEPINE VASOPRESSIN ANTAGONISTS | — | 1998-05-22 | — | — | WO | disclosed |