Known targets — ChEMBL curated mechanism
DHFRGARTPTGFRPTGIRPTGS1PTGS2TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8envmurAthyA
The experimentally established mechanism targets of Tromethamine. 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 | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.38 |
| ▸ | TSHR | P16473 | 4/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.38 |
| ▸ | HPGD | P15428 | 4/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | MPI | P34949 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | HTR1D | P28221 | 1/20 | 0.35 |
| ▸ | HTR1B | P28222 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL302808 | 0.79 | CYP1A2 (0.55) | CYP1A2ALDH1A1TSHRHSD17B10HPGD | |
| SCHEMBL27574908 | 0.77 | CYP1A2 (0.52) | CYP1A2ALDH1A1TSHRHSD17B10HPGD | |
| Water SCHEMBL27559247 | 0.77 | CYP1A2 (0.52) | CYP1A2ALDH1A1TSHRHSD17B10HPGD | |
| Bromide SCHEMBL15845281 | 0.77 | CYP1A2 (0.52) | CYP1A2ALDH1A1TSHRHSD17B10HPGD | |
| Hydrochloric Acid SCHEMBL28343965 | 0.77 | CYP1A2 (0.52) | CYP1A2ALDH1A1TSHRHSD17B10HPGD | |
| SCHEMBL27075400 | 0.77 | CYP1A2 (0.52) | CYP1A2ALDH1A1TSHRHSD17B10HPGD | |
| Fluoride SCHEMBL27890454 | 0.77 | CYP1A2 (0.52) | CYP1A2ALDH1A1TSHRHSD17B10HPGD | |
| Selenic Acid SCHEMBL28804100 | 0.72 | CYP1A2 (0.48) | CYP1A2ALDH1A1TSHRHSD17B10HPGD | |
| Biphenyl SCHEMBL27366995 | 0.71 | CYP1A2 (0.46) | CYP1A2ALDH1A1TSHRHSD17B10HPGD | |
| Tromethamine SCHEMBL7757710 | 0.69 | CA1 (0.41) | CYP1A2ALDH1A1TSHRHSD17B10LMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-1598053-B1 | Use of a composition containing at least one phosphine as majority reducing agent to remove the artificial colour of keratinic fibres | OREAL (FR) | 2006-12-20 | — | — | EP | claimed |