Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TPMT | P51580 | 1/20 | 0.52 |
| ▸ | CNR2 | P34972 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.42 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.42 |
| ▸ | HTR3B | O95264 | 1/20 | 0.42 |
| ▸ | HTR3A | P46098 | 1/20 | 0.42 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.42 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.40 |
| ▸ | HCAR1 | Q9BXC0 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28947533 | 0.90 | TSHR (0.46) | TPMTCNR2MEN1KMT2ANPC1 | |
| SCHEMBL2212388 | 0.80 | TPMT (0.56) | TPMTCNR2MEN1KMT2ANPC1 | |
| SCHEMBL11520841 | 0.80 | TPMT (0.56) | TPMTCNR2MEN1KMT2ANPC1 | |
| SCHEMBL4481639 | 0.79 | PARP1 (0.57) | MEN1KMT2ANPC1RAB9ACYP1A2 | |
| SCHEMBL28859458 | 0.78 | SLC7A5 (0.41) | TPMTCNR2MEN1KMT2ANPC1 | |
| Methyl 3,5-Dimethylbenzoate SCHEMBL334346 | 0.78 | CNR2 (0.66) | TPMTCNR2MEN1KMT2ATDP1 | |
| SCHEMBL6891495 | 0.78 | TPMT (0.54) | TPMTCNR2MEN1KMT2ANPC1 | |
| SCHEMBL7636103 | 0.78 | TPMT (0.54) | TPMTCNR2MEN1KMT2ANPC1 | |
| SCHEMBL27994556 | 0.77 | ATM (0.70) | MEN1KMT2ANPC1RAB9ACYP2C19 | |
| SCHEMBL6426303 | 0.76 | TDP1 (0.64) | MEN1KMT2ANPC1RAB9ACYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-103748076-A | ROR gamma T inhibitors | MERCK SHARP & DOHME | 2014-04-23 | — | — | CN | disclosed |