Known targets — ChEMBL curated mechanism
ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3CALCRLCHRM1CHRM2CHRM3F2RMAOAMAOBMAP2K1MAP2K2NTRK1NTRK2NTRK3OPRD1OPRK1OPRM1P2RY12PKLRSCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASLC18A2SLC6A2SLC6A3TLR7TLR9TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8dacAdacBdacCfolAftsImrcAmrcBmrdApolrplArplBrplCrplDrplErplFrplIrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmB1rpmB2rpmCrpmDrpmErpmE2rpmFrpmGrpmG1rpmG2rpmHrpmIrpmJrpmJ2rpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsR1rpsR2rpsSrpsTrpsUrpsZykgMykgO
The experimentally established mechanism targets of Anisaldehyde. 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 | |
|---|---|---|---|---|
| ▸ | TUBB4A known ✓ | P04350 | 1/20 | 0.44 |
| ▸ | TUBB known ✓ | P07437 | 1/20 | 0.44 |
| ▸ | TUBA3C known ✓ | P0DPH7 | 1/20 | 0.44 |
| ▸ | TUBA1B known ✓ | P68363 | 1/20 | 0.44 |
| ▸ | TUBA4A known ✓ | P68366 | 1/20 | 0.44 |
| ▸ | TUBB4B known ✓ | P68371 | 1/20 | 0.44 |
| ▸ | TUBB3 known ✓ | Q13509 | 1/20 | 0.44 |
| ▸ | TUBB2A known ✓ | Q13885 | 1/20 | 0.44 |
| ▸ | TUBB8 known ✓ | Q3ZCM7 | 1/20 | 0.44 |
| ▸ | TUBA3E known ✓ | Q6PEY2 | 1/20 | 0.44 |
| ▸ | TUBA1A known ✓ | Q71U36 | 1/20 | 0.44 |
| ▸ | TUBA1C known ✓ | Q9BQE3 | 1/20 | 0.44 |
| ▸ | TUBB6 known ✓ | Q9BUF5 | 1/20 | 0.44 |
| ▸ | TUBB2B known ✓ | Q9BVA1 | 1/20 | 0.44 |
| ▸ | TUBB1 known ✓ | Q9H4B7 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.66 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.66 |
| ▸ | THRB | P10828 | 1/20 | 0.50 |
| ▸ | ATM | Q13315 | 1/20 | 0.50 |
| ▸ | F3 | P13726 | 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 | |
|---|---|---|---|---|
| Anisaldehyde SCHEMBL1064748 | 0.98 | ALDH1A1 (0.68) | ALDH1A1CYP2A6THRBATMF3 | |
| Anisaldehyde SCHEMBL28223592 | 0.93 | ALDH1A1 (0.70) | ALDH1A1CYP2A6THRBATMF3 | |
| Anisaldehyde SCHEMBL9090048 | 0.91 | ALDH1A1 (0.79) | ALDH1A1CYP2A6THRBATMF3 | |
| Anisaldehyde SCHEMBL888255 | 0.91 | ALDH1A1 (0.79) | ALDH1A1CYP2A6THRBATMF3 | |
| Anisaldehyde SCHEMBL15602807 | 0.89 | ALDH1A1 (0.76) | ALDH1A1CYP2A6THRBATMF3 | |
| Anisaldehyde SCHEMBL2239445 | 0.85 | ALDH1A1 (0.91) | ALDH1A1CYP2A6THRBATMF3 | |
| Anisaldehyde SCHEMBL2357398 | 0.85 | ALDH1A1 (0.54) | ALDH1A1CYP2A6THRBATMF3 | |
| Anisaldehyde SCHEMBL6910607 | 0.84 | ALDH1A1 (0.68) | ALDH1A1CYP2A6THRBATMF3 | |
| Anisaldehyde SCHEMBL28156946 | 0.83 | ALDH1A1 (0.79) | ALDH1A1CYP2A6THRBATMF3 | |
| Anisaldehyde SCHEMBL717471 | 0.81 | ALDH1A1 (1.00) | ALDH1A1CYP2A6THRBATMF3 |
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 |
|---|---|---|---|---|---|---|---|
| US-5753507-A | HYBRID DNA | NOVARTIS FINANCE CORPORATION (US) | 1998-05-19 | — | — | US | disclosed |
| WO-1997011184-A1 | PLANT GERANIOL/NEROL 10-HYDROXYLASE AND DNA CODING THEREFOR | CIBA GEIGY JAPAN LIMITED (CH) | 1997-03-27 | — | — | WO | disclosed |