Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 3/20 | 0.66 |
| ▸ | PPARG | P37231 | 6/20 | 0.48 |
| ▸ | FFAR1 | O14842 | 3/20 | 0.48 |
| ▸ | MPC2 | O95563 | 1/20 | 0.48 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.43 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.43 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | PPARA | Q07869 | 1/20 | 0.42 |
| ▸ | MAOA | P21397 | 1/20 | 0.42 |
| ▸ | CISD1 | Q9NZ45 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL13846731 | 0.87 | CA2 (0.64) | CA2PPARGFFAR1MPC2CYP2C8 | |
| SCHEMBL8192117 | 0.86 | CA2 (0.64) | CA2PPARGFFAR1MPC2CYP2C8 | |
| SCHEMBL8173780 | 0.80 | CA2 (0.59) | CA2PPARGFFAR1MPC2CYP2C8 | |
| SCHEMBL8179494 | 0.80 | CA2 (0.81) | CA2PPARGMPC2CYP2C8CYP2C9 | |
| SCHEMBL8177729 | 0.79 | CA2 (0.57) | CA2FFAR1MEN1RAB9AKMT2A | |
| SCHEMBL8187284 | 0.79 | CA2 (0.72) | CA2PPARGMPC2CYP2C8CYP2C9 | |
| SCHEMBL8310042 | 0.76 | CA2 (0.56) | CA2PPARGFFAR1MPC2CYP2C8 | |
| SCHEMBL8178940 | 0.75 | PTPN1 (0.56) | CA2PPARGMPC2CYP2C8CYP2C9 | |
| SCHEMBL12961220 | 0.75 | CA2 (0.71) | CA2PPARGMPC2CYP2C8CYP2C9 | |
| SCHEMBL8173454 | 0.74 | CA2 (0.61) | CA2PPARGFFAR1MEN1KMT2A |
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-2000018748-A1 | RHODANINE DERIVATIVES FOR THE TREATMENT AND PREVENTION OF METABOLIC BONE DISORDERS | ROCHE DIAGNOSTICS GMBH (DE) | 2000-04-06 | — | — | WO | disclosed |