Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.51 |
| ▸ | USP2 | O75604 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | OPRD1 | P41143 | 7/20 | 0.45 |
| ▸ | OPRM1 | P35372 | 3/20 | 0.42 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | HTR6 | P50406 | 1/20 | 0.39 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.38 |
| ▸ | HTR3B | O95264 | 1/20 | 0.38 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.38 |
| ▸ | HTR3A | P46098 | 1/20 | 0.38 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.38 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8713369 | 0.84 | OPRD1 (0.49) | ALDH1A1TSHROPRD1OPRM1ADRB1 | |
| SCHEMBL8713649 | 0.79 | OPRD1 (0.43) | SIGMAR1USP2ALDH1A1TSHRHSD17B10 | |
| SCHEMBL8716391 | 0.79 | CTSD (0.43) | SIGMAR1ALDH1A1TSHROPRK1HTR6 | |
| SCHEMBL8716688 | 0.78 | HTR3E (0.50) | ALDH1A1POLBHTR3EHTR3BHTR3A | |
| SCHEMBL379431 | 0.77 | SIGMAR1 (0.51) | SIGMAR1USP2ALDH1A1TSHRHSD17B10 | |
| SCHEMBL8717153 | 0.77 | KMT2A (0.42) | SIGMAR1OPRD1OPRM1OPRK1 | |
| SCHEMBL28770204 | 0.76 | SIGMAR1 (0.50) | SIGMAR1USP2ALDH1A1TSHRHSD17B10 | |
| SCHEMBL8714113 | 0.75 | HRH4 (0.60) | ALDH1A1HSD17B10POLB | |
| SCHEMBL16857496 | 0.73 | CA2 (0.34) | — | |
| SCHEMBL1961974 | 0.72 | CA2 (0.33) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0822939-A1 | CYCLIC PENTAPEPTIDE LH-RH RECEPTOR ANTAGONISTS | Takeda Chemical Industries, Ltd. (JP) | 1998-02-11 | — | — | EP | disclosed |
| WO-1996034012-A1 | CYCLIC PENTAPEPTIDE LH-RH RECEPTOR ANTAGONISTS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1996-10-31 | — | — | WO | disclosed |