Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.33 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.33 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.33 |
| ▸ | MAOB | P27338 | 5/20 | 0.32 |
| ▸ | MAOA | P21397 | 4/20 | 0.32 |
| ▸ | PNMT | P11086 | 1/20 | 0.32 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.32 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.32 |
| ▸ | P2RX1 | P51575 | 1/20 | 0.31 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.31 |
| ▸ | P2RX4 | Q99571 | 1/20 | 0.31 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL16266151 | 0.69 | OPRM1 (0.36) | MEN1KMT2AOPRL1OPRM1OPRK1 | |
| SCHEMBL3819684 | 0.67 | P2RX1 (0.33) | MEN1KMT2ANPC1RAB9ATSHR | |
| SCHEMBL93412 | 0.65 | MEN1 (0.35) | MEN1KMT2ANPC1RAB9ATSHR | |
| SCHEMBL11453271 | 0.65 | CFTR (0.37) | TSHROPRL1OPRM1OPRK1MAOB | |
| SCHEMBL17644608 | 0.65 | OPRM1 (0.39) | MEN1KMT2ATSHROPRL1OPRM1 | |
| SCHEMBL3823998 | 0.65 | PNMT (0.48) | MEN1KMT2AOPRL1OPRM1OPRK1 | |
| SCHEMBL10876622 | 0.63 | OPRM1 (0.41) | MEN1KMT2AOPRL1OPRM1OPRK1 | |
| SCHEMBL5480380 | 0.63 | OPRM1 (0.41) | MEN1KMT2AOPRL1OPRM1OPRK1 | |
| SCHEMBL10571128 | 0.63 | LMNA (0.39) | MEN1KMT2ATSHROPRL1OPRM1 | |
| SCHEMBL10572641 | 0.63 | LMNA (0.39) | MEN1KMT2ATSHROPRL1OPRM1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2770987-B1 | NOVEL COMPOUNDS THAT ARE ERK INHIBITORS | MERCK SHARP & DOHME (US) | 2018-04-04 | — | — | EP | claimed |
| EP-2782903-B1 | NOVEL PYRROLIDINE DERIVATIVES AS INHIBITORS OF CATHEPSIN | HOFFMANN LA ROCHE (CH) | 2016-04-06 | — | — | EP | claimed |
| EP-2421826-B1 | PROLINE DERIVATIVES AS CATHEPSIN INHIBITORS | HOFFMANN LA ROCHE (CH) | 2013-10-23 | — | — | EP | claimed |