Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | F2 | P00734 | 7/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | KLK7 | P49862 | 2/20 | 0.43 |
| ▸ | KLK5 | Q9Y337 | 2/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | KLK14 | Q9P0G3 | 1/20 | 0.43 |
| ▸ | ST14 | Q9Y5Y6 | 1/20 | 0.43 |
| ▸ | F12 | P00748 | 4/20 | 0.43 |
| ▸ | DCTPP1 | Q9H773 | 1/20 | 0.41 |
| ▸ | EGFR | P00533 | 1/20 | 0.41 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.41 |
| ▸ | TUBB | P07437 | 1/20 | 0.41 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.41 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.41 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.41 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.41 |
| ▸ | TUBB3 | Q13509 | 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 | |
|---|---|---|---|---|
| SCHEMBL10991349 | 0.80 | KMT2A (0.43) | F2KMT2AMAPTKLK7KLK5 | |
| SCHEMBL10990639 | 0.78 | BACE1 (0.40) | F2KMT2AMAPTKLK7KLK5 | |
| SCHEMBL14811752 | 0.68 | F12 (0.45) | F2KMT2AMAPTKLK7KLK5 | |
| SCHEMBL10992902 | 0.67 | CYP2A6 (0.41) | KMT2AMAPTCYP2C19ALDH1A1TSHR | |
| SCHEMBL30185823 | 0.66 | CYP2A6 (0.47) | CYP2C19CYP1A2ALDH1A1TSHRTLR8 | |
| SCHEMBL4053682 | 0.66 | CYP2A6 (0.49) | CYP2C19CYP1A2TLR8MEN1CYP2E1 | |
| SCHEMBL13272626 | 0.66 | TDP2 (0.74) | KMT2AMAPTCYP1A2HPGDEGFR | |
| SCHEMBL14822663 | 0.65 | AHR (0.51) | F2KMT2AMAPTKLK7KLK5 | |
| SCHEMBL11589724 | 0.65 | NR1H2 (0.61) | F2KMT2AMAPTKLK7KLK5 | |
| SCHEMBL8405058 | 0.65 | ALDH1A1 (0.50) | F2KMT2AMAPTKLK7KLK5 |
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 |
|---|---|---|---|---|---|---|---|
| US-4497814-A | 2-(Pyridinyl)-1,2,4-triazolo[1,5-a]pyrimidines and derivatives useful in increasing cardiac contractility | SCHERING CORPORATION (US) | 1985-02-05 | — | — | US | disclosed |