Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHFR | P00374 | 3/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
| ▸ | SCNN1A | P37088 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | RARB | P10826 | 6/20 | 0.43 |
| ▸ | MBOAT4 | Q96T53 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | RARA | P10276 | 1/20 | 0.41 |
| ▸ | MTOR | P42345 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9037084 | 0.97 | CYP2D6 (0.55) | DHFRCYP2D6SCNN1AMAPTKMT2A | |
| SCHEMBL9341089 | 0.87 | CYP2D6 (0.53) | DHFRCYP2D6MAPTKMT2APOLB | |
| SCHEMBL9036613 | 0.86 | NPSR1 (0.49) | DHFRCYP2D6SCNN1AMAPTKMT2A | |
| SCHEMBL9338914 | 0.84 | CYP2D6 (0.56) | DHFRCYP2D6SCNN1AMAPTKMT2A | |
| SCHEMBL9343568 | 0.83 | CYP2D6 (0.55) | DHFRCYP2D6SCNN1AMAPTKMT2A | |
| SCHEMBL9037916 | 0.78 | DHFR (0.69) | DHFR | |
| SCHEMBL9039506 | 0.75 | DHFR (0.51) | DHFR | |
| SCHEMBL133470 | 0.74 | RARB (0.68) | MAPTKMT2ARARBMEN1ALDH1A1 | |
| SCHEMBL9339199 | 0.74 | DHFR (0.54) | DHFRCYP2D6SCNN1AMAPTKMT2A | |
| SCHEMBL19143887 | 0.73 | RARB (0.58) | MAPTKMT2ARARBMEN1ALDH1A1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0722440-A1 | PYRIMIDINYL-GLUTAMIC ACID DERIVATIVES | ELI LILLY AND COMPANY (US) | 1996-07-24 | — | — | EP | disclosed |
| EP-0722440-A4 | PYRIMIDINYL-GLUTAMIC ACID DERIVATIVES | LILLY CO ELI (US) | 1996-06-04 | — | — | EP | disclosed |
| US-5426110-A | Inhibiting dihydrofolate reductase in mammals and treating susceptible reoplasms | ELI LILLY AND COMPANY (US) | 1995-06-20 | — | — | US | disclosed |
| WO-1995009845-A1 | PYRIMIDINYL-GLUTAMIC ACID DERIVATIVES | ELI LILLY AND COMPANY (US) | 1995-04-13 | — | — | WO | disclosed |