Known targets — ChEMBL curated mechanism
ADRA2AADRA2BADRA2CADRB2AGTR1AVPR1AAVPR1BAVPR2BDKRB2CALCRCHRNA3CHRNB4ESR1ESR2GHSRGNRHRGSC1HSPA8MALT1MC1RMC4RNOS1NOS2NOS3OPRK1OXTRRAMP1RAMP2RAMP3SCN5ASSTR1SSTR2SSTR3SSTR4SSTR5dacAdacBdacCfolPftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of Desoxycorticosterone. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 8/20 | 0.94 |
| ▸ | SMN1; SMN2 | Q16637 | 7/20 | 0.94 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.94 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.94 |
| ▸ | MAPT | P10636 | 6/20 | 0.94 |
| ▸ | MAPK1 | P28482 | 5/20 | 0.94 |
| ▸ | SHBG | P04278 | 3/20 | 0.94 |
| ▸ | SERPINA6 | P08185 | 3/20 | 0.94 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.94 |
| ▸ | ABCB11 | O95342 | 2/20 | 0.94 |
| ▸ | HIF1A | Q16665 | 4/20 | 0.77 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.77 |
| ▸ | TSHR | P16473 | 3/20 | 0.77 |
| ▸ | NR3C2 | P08235 | 3/20 | 0.77 |
| ▸ | MEN1 | O00255 | 2/20 | 0.77 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.77 |
| ▸ | NR1I2 | O75469 | 2/20 | 0.77 |
| ▸ | NR3C1 | P04150 | 2/20 | 0.77 |
| ▸ | PGR | P06401 | 2/20 | 0.77 |
| ▸ | SLC22A2 | O15244 | 2/20 | 0.77 |
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 | |
|---|---|---|---|---|
| Desoxycorticosterone SCHEMBL21243062 | 0.97 | LMNA (1.00) | LMNASMN1; SMN2ALDH1A1CYP3A4MAPT | |
| Desoxycorticosterone SCHEMBL28269906 | 0.97 | LMNA (1.00) | LMNASMN1; SMN2ALDH1A1CYP3A4MAPT | |
| Desoxycorticosterone SCHEMBL25773308 | 0.97 | LMNA (1.00) | LMNASMN1; SMN2ALDH1A1CYP3A4MAPT | |
| Desoxycorticosterone SCHEMBL13752803 | 0.97 | LMNA (1.00) | LMNASMN1; SMN2ALDH1A1CYP3A4MAPT | |
| Desoxycorticosterone SCHEMBL4065 | 0.97 | LMNA (1.00) | LMNASMN1; SMN2ALDH1A1CYP3A4MAPT | |
| Desoxycorticosterone SCHEMBL4066 | 0.97 | LMNA (1.00) | LMNASMN1; SMN2ALDH1A1CYP3A4MAPT | |
| Desoxycorticosterone SCHEMBL15763287 | 0.97 | LMNA (1.00) | LMNASMN1; SMN2ALDH1A1CYP3A4MAPT | |
| Desoxycorticosterone SCHEMBL18891475 | 0.97 | LMNA (1.00) | LMNASMN1; SMN2ALDH1A1CYP3A4MAPT | |
| Desoxycorticosterone SCHEMBL10593143 | 0.95 | LMNA (0.92) | LMNASMN1; SMN2ALDH1A1CYP3A4MAPT | |
| Progesterone SCHEMBL7714079 | 0.90 | LMNA (0.88) | LMNASMN1; SMN2ALDH1A1CYP3A4MAPT |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-11906510-B2 | Metabolic profiling by reverse-phase/ion-exchange mass spectrometry | STANFORD JUNIOR UNIVERSITY (US) | 2024-02-20 | — | — | US | disclosed |
| US-20210364498-A1 | METABOLIC PROFILING BY REVERSE-PHASE/ION-EXCHANGE MASS SPECTROMETRY | THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) | 2021-11-25 | — | — | US | disclosed |
| EP-0414931-B1 | HYPOTENSIVE AGENT | TANABE SEIYAKU CO (JP) | 1993-07-14 | — | — | EP | disclosed |
| EP-0414931-A1 | Hypotensive agent | TANABE SEIYAKU CO., LTD. (JP) | 1991-03-06 | — | — | EP | disclosed |