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.
⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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 | |
|---|---|---|---|---|
| SCHEMBL11071839 | 0.87 | GAA (0.31) | — | |
| SCHEMBL28993550 | 0.85 | GAA (0.31) | — | |
| Tromethamine SCHEMBL11209439 | 0.69 | MEN1 (0.39) | — | |
| SCHEMBL28213592 | 0.67 | LMNA (0.38) | — | |
| SCHEMBL6118286 | 0.67 | SLC6A4 (0.33) | — | |
| SCHEMBL8860817 | 0.65 | TSHR (0.32) | — | |
| Tromethamine SCHEMBL3398947 | 0.64 | NNMT (0.35) | — | |
| Tromethamine SCHEMBL1683967 | 0.64 | LOXL2 (0.35) | — | |
| SCHEMBL2747909 | 0.63 | — | — | |
| Tromethamine SCHEMBL6235066 | 0.63 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1141613-A1 | PRE-INSULATED PIPES AND PROCESS FOR THEIR PRODUCTION | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 2001-10-10 | — | — | EP | disclosed |
| WO-2000039497-A1 | PRE-INSULATED PIPES AND PROCESS FOR THEIR PRODUCTION | SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) | 2000-07-06 | — | — | WO | disclosed |