Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 2/20 | 0.54 |
| ▸ | DRD2 | P14416 | 5/20 | 0.49 |
| ▸ | DRD3 | P35462 | 5/20 | 0.49 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.49 |
| ▸ | FNTA | P49354 | 3/20 | 0.47 |
| ▸ | FNTB | P49356 | 3/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.44 |
| ▸ | ICMT | O60725 | 1/20 | 0.43 |
| ▸ | DRD4 | P21917 | 4/20 | 0.42 |
| ▸ | CXCR3 | P49682 | 1/20 | 0.40 |
| ▸ | FAAH | O00519 | 1/20 | 0.40 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.40 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL9245521 | 1.00 | TACR1 (0.54) | TACR1DRD2DRD3OPRK1FNTA | |
| SCHEMBL9243104 | 0.93 | TACR1 (0.55) | TACR1DRD2DRD3OPRK1FNTA | |
| SCHEMBL8956827 | 0.93 | TACR1 (0.55) | TACR1DRD2DRD3OPRK1FNTA | |
| SCHEMBL8956847 | 0.91 | TACR1 (0.58) | TACR1DRD2DRD3OPRK1FNTA | |
| SCHEMBL8956681 | 0.91 | TACR1 (0.58) | TACR1DRD2DRD3OPRK1FNTA | |
| SCHEMBL8893638 | 0.88 | DRD2 (0.46) | TACR1DRD2DRD3OPRK1FNTA | |
| SCHEMBL8956909 | 0.83 | TACR1 (0.67) | TACR1FNTAFNTBKDM4ESIGMAR1 | |
| SCHEMBL8545840 | 0.83 | TACR1 (0.67) | TACR1FNTAFNTBKDM4ESIGMAR1 | |
| SCHEMBL9247977 | 0.82 | TACR1 (0.64) | TACR1FNTAFNTBSIGMAR1MEN1 | |
| SCHEMBL8956812 | 0.82 | TACR1 (0.64) | TACR1FNTAFNTBSIGMAR1MEN1 |
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-5484804-A | Perhydroisoindole derivatives as antagonists of substance P | RHONE-POULENC RORER S.A. (FR) | 1996-01-16 | — | — | US | disclosed |