Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TYR | P14679 | 1/20 | 0.36 |
| ▸ | TAAR1 | Q96RJ0 | 4/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.34 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.34 |
| ▸ | DAO | P14920 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | SRC | P12931 | 1/20 | 0.33 |
| ▸ | MIF | P14174 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL2468065 | 1.00 | TYR (0.36) | TYRTAAR1KMT2AKDM4EADRA2A | |
| SCHEMBL8939777 | 1.00 | TYR (0.36) | TYRTAAR1KMT2AKDM4EADRA2A | |
| SCHEMBL4433093 | 0.86 | — | — | |
| SCHEMBL4405618 | 0.84 | ESR1 (0.54) | TYRKMT2AADRA2AADRA2CCYP2D6 | |
| SCHEMBL8094399 | 0.80 | ALOX5AP (0.38) | ALDH1A1 | |
| SCHEMBL7901193 | 0.80 | ALDH1A1 (0.44) | KMT2AKDM4ELMNAALDH1A1 | |
| SCHEMBL11069143 | 0.79 | DPP4 (0.42) | TAAR1KMT2ACYP2D6ALDH1A1SRC | |
| SCHEMBL10823735 | 0.78 | TYR (0.33) | TYRTAAR1KMT2AKDM4EADRA2A | |
| SCHEMBL10446876 | 0.78 | TYR (0.37) | TYRTAAR1KMT2AKDM4EADRA2A | |
| SCHEMBL3840841 | 0.77 | DPP4 (0.40) | TAAR1KMT2ACYP2D6ALDH1A1SRC |
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-5516797-A | SUPPRESSING GRAFT REJECTION | VERTEX PHARMACEUTICALS, INCORPORATED (US) | 1996-05-14 | — | — | US | disclosed |
| US-5330993-A | Immunosuppressive compounds | VERTEX PHARMACEUTICALS, INC. (US) | 1994-07-19 | — | — | US | disclosed |