Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | ABL1 | P00519 | 1/20 | 0.44 |
| ▸ | RIN1 | Q13671 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.41 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | FNTA | P49354 | 1/20 | 0.39 |
| ▸ | FNTB | P49356 | 1/20 | 0.39 |
| ▸ | VNN1 | O95497 | 1/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL10305066 | 0.83 | TDP1 (0.46) | TDP1ABL1RIN1RAB9ANPC1 | |
| SCHEMBL21655417 | 0.78 | HTR2C (0.41) | TDP1ABL1RIN1RAB9ANPC1 | |
| SCHEMBL27322956 | 0.77 | BAZ2B (0.43) | TDP1ABL1RIN1RAB9ANPC1 | |
| SCHEMBL20882979 | 0.77 | GAA (0.45) | TDP1CYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL3461681 | 0.77 | CHRNB2 (0.45) | TDP1CYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL6204342 | 0.75 | KDM4E (0.52) | TDP1CYP1A2CYP3A4KDM4EKMT2A | |
| SCHEMBL7657928 | 0.75 | SMN1; SMN2 (0.40) | TDP1ABL1RIN1RAB9ANPC1 | |
| SCHEMBL14067071 | 0.74 | POLB (0.44) | TDP1RAB9ANPC1CYP1A2CYP3A4 | |
| SCHEMBL19210516 | 0.74 | NPC1 (0.43) | RAB9ANPC1LMNAGAA | |
| SCHEMBL10200511 | 0.74 | CA2 (0.45) | TDP1ABL1RIN1RAB9ANPC1 |
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-2699557-B1 | 3-(OXAZOL-2-YL-ETHOXY)- AND 3-(THIAZOL-2-YL-ETHOXY)-BENZAMIDE DERIVATIVES AS ANTI-BACTERIAL AGENTS | BIOTA SCIENT MANAGEMENT (AU) | 2017-08-16 | — | — | EP | claimed |
| WO-2020023793-A1 | PEGYLATED PRODRUGS OF PHENOLIC TRPV1 AGONISTS | Concentric Analgesics, Inc. (US) | 2020-01-30 | — | — | WO | disclosed |