Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | PNMT | P11086 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.34 |
| ▸ | CYP2A6 | P11509 | 4/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.33 |
| ▸ | IDO1 | P14902 | 3/20 | 0.33 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.33 |
| ▸ | HTR3B | O95264 | 1/20 | 0.33 |
| ▸ | HTR3A | P46098 | 1/20 | 0.33 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.33 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.33 |
| ▸ | DPP4 | P27487 | 1/20 | 0.32 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.32 |
| ▸ | CES2 | O00748 | 1/20 | 0.32 |
| ▸ | CES1 | P23141 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL9846801 | 1.00 | TSHR (0.45) | TSHRLMNAPNMTALDH1A1TAAR1 | |
| SCHEMBL23568725 | 0.83 | PNMT (0.41) | TSHRLMNAPNMTALDH1A1TAAR1 | |
| SCHEMBL23569271 | 0.83 | PNMT (0.41) | TSHRLMNAPNMTALDH1A1TAAR1 | |
| SCHEMBL23569368 | 0.80 | NR4A2 (0.34) | TSHRLMNAPNMTALDH1A1TAAR1 | |
| SCHEMBL23531754 | 0.80 | NR4A2 (0.34) | TSHRLMNAPNMTALDH1A1TAAR1 | |
| SCHEMBL5085586 | 0.78 | TSHR (0.50) | TSHRLMNAPNMTALDH1A1TAAR1 | |
| SCHEMBL11056014 | 0.77 | ADRB1 (0.49) | LMNAALDH1A1RAB9ASMN1; SMN2 | |
| SCHEMBL23569323 | 0.75 | CYP2A6 (0.54) | TSHRLMNACYP2A6CYP1A2NPC1 | |
| SCHEMBL11293986 | 0.74 | CYP1A2 (0.39) | TSHRLMNAPNMTALDH1A1TAAR1 | |
| SCHEMBL15109080 | 0.74 | TSHR (0.45) | TSHRLMNAPNMTALDH1A1TAAR1 |
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-0450487-A1 | Benzoxazine derivatives, method for their preparation and their use for treating or prophylaxis of diseases | HOECHST AKTIENGESELLSCHAFT (DE) | 1991-10-09 | — | — | EP | claimed |
| EP-0450487-A1 | Benzoxazine derivatives, method for their preparation and their use for treating or prophylaxis of diseases | HOECHST AKTIENGESELLSCHAFT (DE) | 1991-10-09 | — | — | EP | disclosed |