Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 10/20 | 0.63 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.63 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | ATM | Q13315 | 1/20 | 0.52 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL12845569 | 0.85 | KDM4E (0.49) | KDM4ETDP1ALDH1A1TSHRATM | |
| SCHEMBL4040473 | 0.84 | KDM4E (0.62) | KDM4ETDP1ALDH1A1TSHRATM | |
| SCHEMBL12781676 | 0.82 | KDM4E (0.60) | KDM4ETDP1ALDH1A1TSHRATM | |
| SCHEMBL14399501 | 0.80 | TSHR (0.61) | KDM4ETDP1ALDH1A1TSHRPOLB | |
| SCHEMBL4043162 | 0.79 | ALDH1A1 (0.62) | KDM4ETDP1ALDH1A1TSHRATM | |
| SCHEMBL12845735 | 0.77 | TSHR (0.66) | KDM4ETDP1ALDH1A1TSHRPOLB | |
| SCHEMBL300800 | 0.74 | LTA4H (0.72) | KDM4EALDH1A1POLBSMN1; SMN2SIGMAR1 | |
| SCHEMBL5024579 | 0.74 | MAPT (0.50) | KDM4ETDP1ALDH1A1MEN1KMT2A | |
| SCHEMBL2088517 | 0.73 | KDM4E (0.50) | KDM4ETDP1ALDH1A1TSHRATM | |
| SCHEMBL10272591 | 0.73 | LTA4H (0.57) | KDM4ETDP1TSHRPOLBMEN1 |
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-7279469-B2 | Diaminotriazoles useful as inhibitors of protein kinases | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2007-10-09 | — | — | US | disclosed |