Known targets — ChEMBL curated mechanism
ACHEBDKRB2CHRM1CHRM2CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNGGUCY1A1GUCY1A2GUCY1B1GUCY1B2NAMPTPTAFRSLC10A2SLC6A2SLC6A3TACR1dacAdacBdacCftsImrcAmrcBmrdA
The experimentally established mechanism targets of Ticlatone. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 known ✓ | P23975 | 2/20 | 0.30 |
| ▸ | SLC6A3 known ✓ | Q01959 | 2/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | CASP3 | P42574 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | DDAH1 | O94760 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.36 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.30 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL192766 | 0.79 | RAB9A (0.36) | ALDH1A1LMNAMAPTPOLBKDM4E | |
| Ticlatone SCHEMBL193888 | 0.76 | ALDH1A1 (0.61) | ALDH1A1LMNAMAPTPOLBCASP3 | |
| Ticlatone SCHEMBL30165586 | 0.76 | ALDH1A1 (0.61) | ALDH1A1LMNAMAPTPOLBCASP3 | |
| Tiodonium SCHEMBL192767 | 0.65 | LMNA (0.36) | ALDH1A1LMNAMAPTPOLBKDM4E | |
| SCHEMBL79949 | 0.64 | LMNA (0.53) | ALDH1A1LMNAMAPTPOLBCASP3 | |
| Tiodonium SCHEMBL2110688 | 0.64 | LMNA (0.37) | ALDH1A1LMNAMAPTPOLBKDM4E | |
| Hydrochloric Acid SCHEMBL11452803 | 0.63 | TSHR (0.40) | ALDH1A1LMNAMAPTPOLBKDM4E | |
| Tiodonium SCHEMBL1305415 | 0.62 | LMNA (0.36) | ALDH1A1LMNAMAPTPOLBKDM4E | |
| Hydrochloric Acid SCHEMBL11776201 | 0.62 | KDM1A (0.35) | LMNAMAPTPOLBKDM4EHTT | |
| Hydrochloric Acid SCHEMBL11777898 | 0.62 | L3MBTL1 (0.38) | ALDH1A1LMNAMAPTPOLBNPC1 |
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-2002071927-A9 | DIAGNOSIS AND TREATMENT OF SKELETAL DEGENERATION CONDITIONS | BRIGHAM & WOMENS HOSPITAL (US) | 2004-08-12 | — | — | WO | disclosed |