Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.32 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.32 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.32 |
| ▸ | GABRA4 | P48169 | 2/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.32 |
| ▸ | GABRR1 | P24046 | 1/20 | 0.32 |
| ▸ | GABRR2 | P28476 | 1/20 | 0.32 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.31 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.31 |
| ▸ | PTGDR2 | Q9Y5Y4 | 4/20 | 0.31 |
| ▸ | GABRP | O00591 | 1/20 | 0.30 |
| ▸ | GABRD | O14764 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL3721023 | 0.80 | DPP4 (0.43) | KDM4EMAPTALDH1A1TSHRTDP1 | |
| SCHEMBL27350686 | 0.71 | TDP1 (0.49) | KDM4EMAPTCYP1A2ALDH1A1TDP1 | |
| SCHEMBL9431109 | 0.70 | PIK3CG (0.33) | — | |
| SCHEMBL479502 | 0.68 | CYP2C19 (0.37) | KDM4EMAPTALDH1A1GABRA1GABRA5 | |
| SCHEMBL12436875 | 0.67 | GABRA5 (0.42) | KDM4EMAPTCYP1A2ALDH1A1GABRA1 | |
| SCHEMBL907669 | 0.67 | KDM4E (0.37) | KDM4EMAPTCYP1A2ALDH1A1GABRA1 | |
| SCHEMBL3720458 | 0.67 | MEN1 (0.38) | KDM4EMAPTCYP1A2ALDH1A1 | |
| SCHEMBL3719119 | 0.65 | GABRA5 (0.33) | KDM4EMAPTALDH1A1GABRA1GABRA5 | |
| SCHEMBL27845043 | 0.63 | AGBL2 (0.41) | KDM4EMAPTCYP1A2ALDH1A1GABRA1 | |
| SCHEMBL907750 | 0.63 | HSD17B10 (0.39) | KDM4EMAPTCYP1A2ALDH1A1GABRA1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010125469-A1 | PYRIMIDINEDIONE-FUSED HETEROCYCLIC COMPOUNDS AS TRPA1 MODULATORS | GLENMARK PHARMACEUTICALS, S.A. (CH) | 2010-11-04 | — | — | WO | disclosed |