Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C4 | P17516 | 1/20 | 0.54 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.54 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.54 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.54 |
| ▸ | CA12 | O43570 | 1/20 | 0.53 |
| ▸ | CA1 | P00915 | 1/20 | 0.53 |
| ▸ | CA7 | P43166 | 1/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | HPGD | P15428 | 4/20 | 0.48 |
| ▸ | POLB | P06746 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 4/20 | 0.48 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.47 |
| ▸ | PIM1 | P11309 | 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 | |
|---|---|---|---|---|
| SCHEMBL19554122 | 0.92 | AKR1C4 (0.61) | AKR1C4AKR1C3AKR1C2AKR1C1CA12 | |
| SCHEMBL19554108 | 0.86 | CYP1A2 (0.55) | AKR1C4AKR1C3AKR1C2AKR1C1CA12 | |
| SCHEMBL19575780 | 0.85 | AKR1C4 (0.55) | AKR1C4AKR1C3AKR1C2AKR1C1CA12 | |
| SCHEMBL19554093 | 0.84 | SMN1; SMN2 (0.62) | AKR1C4AKR1C3AKR1C2AKR1C1CA12 | |
| SCHEMBL19554300 | 0.81 | MAPT (0.56) | AKR1C4AKR1C3AKR1C2AKR1C1CA12 | |
| SCHEMBL19554219 | 0.81 | AKR1C4 (0.48) | AKR1C4AKR1C3AKR1C2AKR1C1CA12 | |
| SCHEMBL19554290 | 0.79 | SMN1; SMN2 (0.47) | AKR1C4AKR1C3AKR1C2AKR1C1KDM4E | |
| SCHEMBL19554152 | 0.78 | MEN1 (0.47) | AKR1C4AKR1C3AKR1C2AKR1C1CA12 | |
| SCHEMBL19554123 | 0.77 | KCNK2 (0.50) | AKR1C2AKR1C1CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL19554111 | 0.75 | KMT2A (0.58) | AKR1C4AKR1C3AKR1C2AKR1C1CA12 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2017192304-A1 | ARYLCARBOXAMIDES AND USES THEREOF | INCEPTION 1, INC. (US) | 2017-11-09 | — | — | WO | claimed |
| WO-2017192304-A1 | ARYLCARBOXAMIDES AND USES THEREOF | INCEPTION 1, INC. (US) | 2017-11-09 | — | — | WO | disclosed |
| WO-2017192304-A1 | ARYLCARBOXAMIDES AND USES THEREOF | INCEPTION 1, INC. (US) | 2017-11-09 | — | — | WO | disclosed |