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 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 12/20 | 0.37 |
| ▸ | ADORA1 | P30542 | 9/20 | 0.37 |
| ▸ | CXCR4 | P61073 | 3/20 | 0.36 |
| ▸ | SCN8A | Q9UQD0 | 2/20 | 0.36 |
| ▸ | SLC40A1 | Q9NP59 | 1/20 | 0.35 |
| ▸ | SSTR4 | P31391 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL4620705 | 0.89 | SCN8A (0.42) | ADORA2AADORA1CXCR4SCN8AMEN1 | |
| Tromethamine SCHEMBL6204282 | 0.84 | TRPV1 (0.35) | ADORA2ASLC40A1ALDH1A1 | |
| SCHEMBL2082460 | 0.75 | NOS3 (0.45) | ADORA2AADORA1SCN8A | |
| SCHEMBL23428554 | 0.75 | SCN8A (0.44) | ADORA2AADORA1SCN8ASMN1; SMN2 | |
| SCHEMBL16268934 | 0.74 | OPRM1 (0.41) | ADORA2AADORA1SCN8ASLC40A1SSTR4 | |
| SCHEMBL19865638 | 0.73 | CHRM2 (0.46) | SCN8AMEN1KMT2ASMN1; SMN2 | |
| SCHEMBL20482639 | 0.72 | ADORA2A (0.45) | ADORA2AADORA1SCN8ASLC40A1ALDH1A1 | |
| SCHEMBL2083712 | 0.72 | NOS3 (0.40) | ADORA2AADORA1CXCR4SSTR4 | |
| SCHEMBL2261106 | 0.71 | NOS3 (0.41) | ADORA2AADORA1ALDH1A1 | |
| SCHEMBL5968788 | 0.71 | HTR5A (0.37) | ADORA2AALDH1A1 |
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-1506277-A1 | ENZYMATIC DETERGENT COMPOSITIONS | UNILEVER N.V. (NL) | 2005-02-16 | — | — | EP | disclosed |
| WO-2003097780-A1 | ENZYMATIC DETERGENT COMPOSITIONS | UNILEVER N.V. (NL) | 2003-11-27 | — | — | WO | disclosed |